 Entering Gaussian System, Link 0=g16
 Input=23_tartaric_acid_300_STD_LCPBE_augccpVDZ.in
 Output=23_tartaric_acid_300_STD_LCPBE_augccpVDZ.log
 AtFile(1): /user/pierpa/basis_sets/augccpVDZ.gbs
            -H     0
            S    4   1.00
                  1.301000D+01           1.968500D-02
                  1.962000D+00           1.379770D-01
                  4.446000D-01           4.781480D-01
                  1.220000D-01           5.012400D-01
            S    1   1.00
                  1.220000D-01           1.000000D+00
            S    1   1.00
                  0.0297400              1.0000000
            P    1   1.00
                  7.270000D-01           1.0000000
            P    1   1.00
                  0.1410000              1.0000000
            ****
            -He     0
            S    4   1.00
                  3.836000D+01           2.380900D-02
                  5.770000D+00           1.548910D-01
                  1.240000D+00           4.699870D-01
                  2.976000D-01           5.130270D-01
            S    1   1.00
                  2.976000D-01           1.000000D+00
            S    1   1.00
                  0.0725500              1.0000000
            P    1   1.00
                  1.275000D+00           1.0000000
            P    1   1.00
                  0.2473000              1.0000000
            ****
            -Li     0
            S    9   1.00
                  1.469000D+03           7.660000D-04
                  2.205000D+02           5.892000D-03
                  5.026000D+01           2.967100D-02
                  1.424000D+01           1.091800D-01
                  4.581000D+00           2.827890D-01
                  1.580000D+00           4.531230D-01
                  5.640000D-01           2.747740D-01
                  7.345000D-02           9.751000D-03
                  2.805000D-02          -3.180000D-03
            S    9   1.00
                  1.469000D+03          -1.200000D-04
                  2.205000D+02          -9.230000D-04
                  5.026000D+01          -4.689000D-03
                  1.424000D+01          -1.768200D-02
                  4.581000D+00          -4.890200D-02
                  1.580000D+00          -9.600900D-02
                  5.640000D-01          -1.363800D-01
                  7.345000D-02           5.751020D-01
                  2.805000D-02           5.176610D-01
            S    1   1.00
                  2.805000D-02           1.000000D+00
            S    1   1.00
                  8.600000D-03           1.000000D+00
            P    4   1.00
                  1.534000D+00           2.278400D-02
                  2.749000D-01           1.391070D-01
                  7.362000D-02           5.003750D-01
                  2.403000D-02           5.084740D-01
            P    1   1.00
                  2.403000D-02           1.000000D+00
            P    1   1.00
                  5.800000D-03           1.000000D+00
            D    1   1.00
                  1.144000D-01           1.0000000
            D    1   1.00
                  7.330000D-02           1.000000D+00
            ****
            -Be     0
            S    9   1.00
                  2.940000D+03           6.800000D-04
                  4.412000D+02           5.236000D-03
                  1.005000D+02           2.660600D-02
                  2.843000D+01           9.999300D-02
                  9.169000D+00           2.697020D-01
                  3.196000D+00           4.514690D-01
                  1.159000D+00           2.950740D-01
                  1.811000D-01           1.258700D-02
                  5.890000D-02          -3.756000D-03
            S    9   1.00
                  2.940000D+03          -1.230000D-04
                  4.412000D+02          -9.660000D-04
                  1.005000D+02          -4.831000D-03
                  2.843000D+01          -1.931400D-02
                  9.169000D+00          -5.328000D-02
                  3.196000D+00          -1.207230D-01
                  1.159000D+00          -1.334350D-01
                  1.811000D-01           5.307670D-01
                  5.890000D-02           5.801170D-01
            S    1   1.00
                  5.890000D-02           1.000000D+00
            S    1   1.00
                  1.790000D-02           1.000000D+00
            P    4   1.00
                  3.619000D+00           2.911100D-02
                  7.110000D-01           1.693650D-01
                  1.951000D-01           5.134580D-01
                  6.018000D-02           4.793380D-01
            P    1   1.00
                  6.018000D-02           1.000000D+00
            P    1   1.00
                  1.110000D-02           1.000000D+00
            D    1   1.00
                  2.354000D-01           1.0000000
            D    1   1.00
                  7.220000D-02           1.000000D+00
            ****
            -B     0
            S    9   1.00
                  4.570000D+03           6.960000D-04
                  6.859000D+02           5.353000D-03
                  1.565000D+02           2.713400D-02
                  4.447000D+01           1.013800D-01
                  1.448000D+01           2.720550D-01
                  5.131000D+00           4.484030D-01
                  1.898000D+00           2.901230D-01
                  3.329000D-01           1.432200D-02
                  1.043000D-01          -3.486000D-03
            S    9   1.00
                  4.570000D+03          -1.390000D-04
                  6.859000D+02          -1.097000D-03
                  1.565000D+02          -5.444000D-03
                  4.447000D+01          -2.191600D-02
                  1.448000D+01          -5.975100D-02
                  5.131000D+00          -1.387320D-01
                  1.898000D+00          -1.314820D-01
                  3.329000D-01           5.395260D-01
                  1.043000D-01           5.807740D-01
            S    1   1.00
                  1.043000D-01           1.000000D+00
            S    1   1.00
                  0.0310500              1.0000000
            P    4   1.00
                  6.001000D+00           3.548100D-02
                  1.241000D+00           1.980720D-01
                  3.364000D-01           5.052300D-01
                  9.538000D-02           4.794990D-01
            P    1   1.00
                  9.538000D-02           1.000000D+00
            P    1   1.00
                  0.0237800              1.0000000
            D    1   1.00
                  3.430000D-01           1.0000000
            D    1   1.00
                  0.0904000              1.0000000
            ****
            -C     0
            S    9   1.00
                  6.665000D+03           6.920000D-04
                  1.000000D+03           5.329000D-03
                  2.280000D+02           2.707700D-02
                  6.471000D+01           1.017180D-01
                  2.106000D+01           2.747400D-01
                  7.495000D+00           4.485640D-01
                  2.797000D+00           2.850740D-01
                  5.215000D-01           1.520400D-02
                  1.596000D-01          -3.191000D-03
            S    9   1.00
                  6.665000D+03          -1.460000D-04
                  1.000000D+03          -1.154000D-03
                  2.280000D+02          -5.725000D-03
                  6.471000D+01          -2.331200D-02
                  2.106000D+01          -6.395500D-02
                  7.495000D+00          -1.499810D-01
                  2.797000D+00          -1.272620D-01
                  5.215000D-01           5.445290D-01
                  1.596000D-01           5.804960D-01
            S    1   1.00
                  1.596000D-01           1.000000D+00
            S    1   1.00
                  0.0469000              1.0000000
            P    4   1.00
                  9.439000D+00           3.810900D-02
                  2.002000D+00           2.094800D-01
                  5.456000D-01           5.085570D-01
                  1.517000D-01           4.688420D-01
            P    1   1.00
                  1.517000D-01           1.000000D+00
            P    1   1.00
                  0.0404100              1.0000000
            D    1   1.00
                  5.500000D-01           1.0000000
            D    1   1.00
                  0.1510000              1.0000000
            ****
            -N     0
            S    9   1.00
                  9.046000D+03           7.000000D-04
                  1.357000D+03           5.389000D-03
                  3.093000D+02           2.740600D-02
                  8.773000D+01           1.032070D-01
                  2.856000D+01           2.787230D-01
                  1.021000D+01           4.485400D-01
                  3.838000D+00           2.782380D-01
                  7.466000D-01           1.544000D-02
                  2.248000D-01          -2.864000D-03
            S    9   1.00
                  9.046000D+03          -1.530000D-04
                  1.357000D+03          -1.208000D-03
                  3.093000D+02          -5.992000D-03
                  8.773000D+01          -2.454400D-02
                  2.856000D+01          -6.745900D-02
                  1.021000D+01          -1.580780D-01
                  3.838000D+00          -1.218310D-01
                  7.466000D-01           5.490030D-01
                  2.248000D-01           5.788150D-01
            S    1   1.00
                  2.248000D-01           1.000000D+00
            S    1   1.00
                  0.0612400              1.0000000
            P    4   1.00
                  1.355000D+01           3.991900D-02
                  2.917000D+00           2.171690D-01
                  7.973000D-01           5.103190D-01
                  2.185000D-01           4.622140D-01
            P    1   1.00
                  2.185000D-01           1.000000D+00
            P    1   1.00
                  0.0561100              1.0000000
            D    1   1.00
                  8.170000D-01           1.0000000
            D    1   1.00
                  0.2300000              1.0000000
            ****
            -O     0
            S    9   1.00
                  1.172000D+04           7.100000D-04
                  1.759000D+03           5.470000D-03
                  4.008000D+02           2.783700D-02
                  1.137000D+02           1.048000D-01
                  3.703000D+01           2.830620D-01
                  1.327000D+01           4.487190D-01
                  5.025000D+00           2.709520D-01
                  1.013000D+00           1.545800D-02
                  3.023000D-01          -2.585000D-03
            S    9   1.00
                  1.172000D+04          -1.600000D-04
                  1.759000D+03          -1.263000D-03
                  4.008000D+02          -6.267000D-03
                  1.137000D+02          -2.571600D-02
                  3.703000D+01          -7.092400D-02
                  1.327000D+01          -1.654110D-01
                  5.025000D+00          -1.169550D-01
                  1.013000D+00           5.573680D-01
                  3.023000D-01           5.727590D-01
            S    1   1.00
                  3.023000D-01           1.000000D+00
            S    1   1.00
                  0.0789600              1.0000000
            P    4   1.00
                  1.770000D+01           4.301800D-02
                  3.854000D+00           2.289130D-01
                  1.046000D+00           5.087280D-01
                  2.753000D-01           4.605310D-01
            P    1   1.00
                  2.753000D-01           1.000000D+00
            P    1   1.00
                  0.0685600              1.0000000
            D    1   1.00
                  1.185000D+00           1.0000000
            D    1   1.00
                  0.3320000              1.0000000
            ****
            -F     0
            S    9   1.00
                  1.471000D+04           7.210000D-04
                  2.207000D+03           5.553000D-03
                  5.028000D+02           2.826700D-02
                  1.426000D+02           1.064440D-01
                  4.647000D+01           2.868140D-01
                  1.670000D+01           4.486410D-01
                  6.356000D+00           2.647610D-01
                  1.316000D+00           1.533300D-02
                  3.897000D-01          -2.332000D-03
            S    9   1.00
                  1.471000D+04          -1.650000D-04
                  2.207000D+03          -1.308000D-03
                  5.028000D+02          -6.495000D-03
                  1.426000D+02          -2.669100D-02
                  4.647000D+01          -7.369000D-02
                  1.670000D+01          -1.707760D-01
                  6.356000D+00          -1.123270D-01
                  1.316000D+00           5.628140D-01
                  3.897000D-01           5.687780D-01
            S    1   1.00
                  3.897000D-01           1.000000D+00
            S    1   1.00
                  0.0986300              1.0000000
            P    4   1.00
                  2.267000D+01           4.487800D-02
                  4.977000D+00           2.357180D-01
                  1.347000D+00           5.085210D-01
                  3.471000D-01           4.581200D-01
            P    1   1.00
                  3.471000D-01           1.000000D+00
            P    1   1.00
                  0.0850200              1.0000000
            D    1   1.00
                  1.640000D+00           1.0000000
            D    1   1.00
                  0.4640000              1.0000000
            ****
            -Ne     0
            S    9   1.00
                  1.788000D+04           7.380000D-04
                  2.683000D+03           5.677000D-03
                  6.115000D+02           2.888300D-02
                  1.735000D+02           1.085400D-01
                  5.664000D+01           2.909070D-01
                  2.042000D+01           4.483240D-01
                  7.810000D+00           2.580260D-01
                  1.653000D+00           1.506300D-02
                  4.869000D-01          -2.100000D-03
            S    9   1.00
                  1.788000D+04          -1.720000D-04
                  2.683000D+03          -1.357000D-03
                  6.115000D+02          -6.737000D-03
                  1.735000D+02          -2.766300D-02
                  5.664000D+01          -7.620800D-02
                  2.042000D+01          -1.752270D-01
                  7.810000D+00          -1.070380D-01
                  1.653000D+00           5.670500D-01
                  4.869000D-01           5.652160D-01
            S    1   1.00
                  4.869000D-01           1.000000D+00
            S    1   1.00
                  0.1230000              1.0000000
            P    4   1.00
                  2.839000D+01           4.608700D-02
                  6.270000D+00           2.401810D-01
                  1.695000D+00           5.087440D-01
                  4.317000D-01           4.556600D-01
            P    1   1.00
                  4.317000D-01           1.000000D+00
            P    1   1.00
                  0.1064000              1.0000000
            D    1   1.00
                  2.202000D+00           1.0000000
            D    1   1.00
                  0.6310000              1.0000000
            ****
            -Na     0
            S    12   1.00
                  3.170000D+04           4.588780D-04
                  4.755000D+03           3.550700D-03
                  1.082000D+03           1.826180D-02
                  3.064000D+02           7.166500D-02
                  9.953000D+01           2.123460D-01
                  3.542000D+01           4.162030D-01
                  1.330000D+01           3.730200D-01
                  4.392000D+00           6.250540D-02
                  1.676000D+00          -6.245320D-03
                  5.889000D-01           2.433740D-03
                  5.640000D-02          -4.423810D-04
                  2.307000D-02           2.419240D-04
            S    12   1.00
                  3.170000D+04          -1.121620D-04
                  4.755000D+03          -8.685120D-04
                  1.082000D+03          -4.513300D-03
                  3.064000D+02          -1.814360D-02
                  9.953000D+01          -5.807990D-02
                  3.542000D+01          -1.376530D-01
                  1.330000D+01          -1.939080D-01
                  4.392000D+00           8.580090D-02
                  1.676000D+00           6.044190D-01
                  5.889000D-01           4.417190D-01
                  5.640000D-02           1.305470D-02
                  2.307000D-02          -5.680850D-03
            S    12   1.00
                  3.170000D+04           1.701600D-05
                  4.755000D+03           1.306930D-04
                  1.082000D+03           6.877840D-04
                  3.064000D+02           2.723590D-03
                  9.953000D+01           8.955290D-03
                  3.542000D+01           2.078320D-02
                  1.330000D+01           3.193800D-02
                  4.392000D+00          -1.913680D-02
                  1.676000D+00          -1.025950D-01
                  5.889000D-01          -1.989450D-01
                  5.640000D-02           6.559520D-01
                  2.307000D-02           4.311530D-01
            S    1   1.00
                  2.307000D-02           1.000000D+00
            S    1   1.00
                  7.200000D-03           1.000000D+00
            P    8   1.00
                  1.381000D+02           5.796410D-03
                  3.224000D+01           4.157560D-02
                  9.985000D+00           1.628730D-01
                  3.484000D+00           3.594010D-01
                  1.231000D+00           4.499880D-01
                  4.177000D-01           2.275070D-01
                  6.513000D-02           8.082470D-03
                  2.053000D-02          -1.962930D-03
            P    8   1.00
                  1.381000D+02          -5.815310D-04
                  3.224000D+01          -4.073060D-03
                  9.985000D+00          -1.679370D-02
                  3.484000D+00          -3.532680D-02
                  1.231000D+00          -5.219710D-02
                  4.177000D-01          -1.683590D-02
                  6.513000D-02           4.346130D-01
                  2.053000D-02           6.582180D-01
            P    1   1.00
                  2.053000D-02           1.000000D+00
            P    1   1.00
                  5.700000D-03           1.000000D+00
            D    1   1.00
                  9.280000D-02           1.0000000
            D    1   1.00
                  4.800000D-02           1.000000D+00
            ****
            -Mg     0
            S    12   1.00
                  4.739000D+04           3.460230D-04
                  7.108000D+03           2.680770D-03
                  1.618000D+03           1.383670D-02
                  4.584000D+02           5.517670D-02
                  1.493000D+02           1.696600D-01
                  5.359000D+01           3.647030D-01
                  2.070000D+01           4.068560D-01
                  8.384000D+00           1.350890D-01
                  2.542000D+00           4.908840D-03
                  8.787000D-01           2.864600D-04
                  1.077000D-01           2.645900D-05
                  3.999000D-02          -1.127080D-05
            S    12   1.00
                  4.739000D+04          -8.778390D-05
                  7.108000D+03          -6.747250D-04
                  1.618000D+03          -3.556030D-03
                  4.584000D+02          -1.421540D-02
                  1.493000D+02          -4.767480D-02
                  5.359000D+01          -1.148920D-01
                  2.070000D+01          -2.006760D-01
                  8.384000D+00          -3.412240D-02
                  2.542000D+00           5.704540D-01
                  8.787000D-01           5.423090D-01
                  1.077000D-01           2.181280D-02
                  3.999000D-02          -8.277000D-03
            S    12   1.00
                  4.739000D+04           1.696280D-05
                  7.108000D+03           1.298650D-04
                  1.618000D+03           6.888310D-04
                  4.584000D+02           2.735330D-03
                  1.493000D+02           9.312240D-03
                  5.359000D+01           2.232650D-02
                  2.070000D+01           4.111950D-02
                  8.384000D+00           5.456420D-03
                  2.542000D+00          -1.340120D-01
                  8.787000D-01          -2.561760D-01
                  1.077000D-01           6.058560D-01
                  3.999000D-02           5.094460D-01
            S    1   1.00
                  3.999000D-02           1.000000D+00
            S    1   1.00
                  1.420000D-02           1.000000D+00
            P    8   1.00
                  1.799000D+02           5.381610D-03
                  4.214000D+01           3.924180D-02
                  1.313000D+01           1.574450D-01
                  4.628000D+00           3.585350D-01
                  1.670000D+00           4.572260D-01
                  5.857000D-01           2.159180D-01
                  1.311000D-01           6.649480D-03
                  4.112000D-02          -1.253040D-04
            P    8   1.00
                  1.799000D+02          -8.659480D-04
                  4.214000D+01          -6.159780D-03
                  1.313000D+01          -2.615190D-02
                  4.628000D+00          -5.706470D-02
                  1.670000D+00          -8.739060D-02
                  5.857000D-01          -1.229900D-02
                  1.311000D-01           5.020850D-01
                  4.112000D-02           5.972450D-01
            P    1   1.00
                  4.112000D-02           1.000000D+00
            P    1   1.00
                  1.050000D-02           1.000000D+00
            D    1   1.00
                  1.932000D-01           1.0000000
            D    1   1.00
                  6.050000D-02           1.000000D+00
            ****
            -Al     0
            S    12   1.00
                  6.415000D+04           2.902500D-04
                  9.617000D+03           2.250640D-03
                  2.189000D+03           1.164590D-02
                  6.205000D+02           4.673770D-02
                  2.027000D+02           1.462990D-01
                  7.315000D+01           3.302830D-01
                  2.855000D+01           4.158610D-01
                  1.177000D+01           1.892530D-01
                  3.300000D+00           1.158890D-02
                  1.173000D+00          -1.283850D-03
                  1.752000D-01           4.258830D-04
                  6.473000D-02          -1.992800D-04
            S    12   1.00
                  6.415000D+04          -7.580480D-05
                  9.617000D+03          -5.817910D-04
                  2.189000D+03          -3.081130D-03
                  6.205000D+02          -1.231120D-02
                  2.027000D+02          -4.197810D-02
                  7.315000D+01          -1.033710D-01
                  2.855000D+01          -1.963080D-01
                  1.177000D+01          -8.300020D-02
                  3.300000D+00           5.410400D-01
                  1.173000D+00           5.787960D-01
                  1.752000D-01           2.881470D-02
                  6.473000D-02          -9.537950D-03
            S    12   1.00
                  6.415000D+04           1.750780D-05
                  9.617000D+03           1.342080D-04
                  2.189000D+03           7.124420D-04
                  6.205000D+02           2.843300D-03
                  2.027000D+02           9.768420D-03
                  7.315000D+01           2.418500D-02
                  2.855000D+01           4.749930D-02
                  1.177000D+01           2.036210D-02
                  3.300000D+00          -1.587880D-01
                  1.173000D+00          -3.116940D-01
                  1.752000D-01           6.201470D-01
                  6.473000D-02           5.209430D-01
            S    1   1.00
                  6.473000D-02           1.000000D+00
            S    1   1.00
                  0.0231000              1.0000000
            P    8   1.00
                  2.588000D+02           4.068470D-03
                  6.089000D+01           3.068150D-02
                  1.914000D+01           1.291490D-01
                  6.881000D+00           3.208310D-01
                  2.574000D+00           4.538150D-01
                  9.572000D-01           2.750660D-01
                  2.099000D-01           1.908070D-02
                  5.986000D-02          -3.128480D-03
            P    8   1.00
                  2.588000D+02          -7.480530D-04
                  6.089000D+01          -5.457960D-03
                  1.914000D+01          -2.453710D-02
                  6.881000D+00          -5.821380D-02
                  2.574000D+00          -9.837560D-02
                  9.572000D-01          -2.600640D-02
                  2.099000D-01           4.640200D-01
                  5.986000D-02           6.488700D-01
            P    1   1.00
                  5.986000D-02           1.000000D+00
            P    1   1.00
                  0.0153000              1.0000000
            D    1   1.00
                  1.890000D-01           1.0000000
            D    1   1.00
                  0.0535000              1.0000000
            ****
            -Si     0
            S    12   1.00
                  7.886000D+04           2.704430D-04
                  1.182000D+04           2.097170D-03
                  2.692000D+03           1.085060D-02
                  7.634000D+02           4.367540D-02
                  2.496000D+02           1.376530D-01
                  9.028000D+01           3.166440D-01
                  3.529000D+01           4.185810D-01
                  1.451000D+01           2.102120D-01
                  4.053000D+00           1.449520D-02
                  1.482000D+00          -2.035900D-03
                  2.517000D-01           6.241860D-04
                  9.243000D-02          -2.828720D-04
            S    12   1.00
                  7.886000D+04          -7.231770D-05
                  1.182000D+04          -5.551160D-04
                  2.692000D+03          -2.938050D-03
                  7.634000D+02          -1.176870D-02
                  2.496000D+02          -4.029070D-02
                  9.028000D+01          -1.006090D-01
                  3.529000D+01          -1.965280D-01
                  1.451000D+01          -1.023820D-01
                  4.053000D+00           5.271900D-01
                  1.482000D+00           5.932510D-01
                  2.517000D-01           3.326520D-02
                  9.243000D-02          -9.736620D-03
            S    12   1.00
                  7.886000D+04           1.851130D-05
                  1.182000D+04           1.422360D-04
                  2.692000D+03           7.521850D-04
                  7.634000D+02           3.022790D-03
                  2.496000D+02           1.036770D-02
                  9.028000D+01           2.625630D-02
                  3.529000D+01           5.239890D-02
                  1.451000D+01           2.909590D-02
                  4.053000D+00          -1.780030D-01
                  1.482000D+00          -3.468740D-01
                  2.517000D-01           6.230200D-01
                  9.243000D-02           5.377120D-01
            S    1   1.00
                  9.243000D-02           1.000000D+00
            S    1   1.00
                  0.0332000              1.0000000
            P    8   1.00
                  3.159000D+02           3.926560D-03
                  7.442000D+01           2.988110D-02
                  2.348000D+01           1.272120D-01
                  8.488000D+00           3.209430D-01
                  3.217000D+00           4.554290D-01
                  1.229000D+00           2.685630D-01
                  2.964000D-01           1.883360D-02
                  8.768000D-02          -2.624310D-03
            P    8   1.00
                  3.159000D+02          -8.583020D-04
                  7.442000D+01          -6.303280D-03
                  2.348000D+01          -2.882550D-02
                  8.488000D+00          -6.945600D-02
                  3.217000D+00          -1.194930D-01
                  1.229000D+00          -1.995810D-02
                  2.964000D-01           5.102680D-01
                  8.768000D-02           6.003820D-01
            P    1   1.00
                  8.768000D-02           1.000000D+00
            P    1   1.00
                  0.0250000              1.0000000
            D    1   1.00
                  2.750000D-01           1.0000000
            D    1   1.00
                  0.0823000              1.0000000
            ****
            -P     0
            S    12   1.00
                  9.484000D+04           2.555090D-04
                  1.422000D+04           1.981930D-03
                  3.236000D+03           1.027600D-02
                  9.171000D+02           4.148230D-02
                  2.995000D+02           1.319840D-01
                  1.081000D+02           3.086620D-01
                  4.218000D+01           4.206470D-01
                  1.728000D+01           2.228780D-01
                  4.858000D+00           1.640350D-02
                  1.818000D+00          -2.542550D-03
                  3.372000D-01           7.480500D-04
                  1.232000D-01          -3.309630D-04
            S    12   1.00
                  9.484000D+04          -6.969390D-05
                  1.422000D+04          -5.352660D-04
                  3.236000D+03          -2.837090D-03
                  9.171000D+02          -1.139830D-02
                  2.995000D+02          -3.929290D-02
                  1.081000D+02          -9.963640D-02
                  4.218000D+01          -1.979830D-01
                  1.728000D+01          -1.148600D-01
                  4.858000D+00           5.185950D-01
                  1.818000D+00           6.018470D-01
                  3.372000D-01           3.686120D-02
                  1.232000D-01          -9.707590D-03
            S    12   1.00
                  9.484000D+04           1.911990D-05
                  1.422000D+04           1.472230D-04
                  3.236000D+03           7.779120D-04
                  9.171000D+02           3.145460D-03
                  2.995000D+02           1.082000D-02
                  1.081000D+02           2.799570D-02
                  4.218000D+01           5.639780D-02
                  1.728000D+01           3.581900D-02
                  4.858000D+00          -1.933870D-01
                  1.818000D+00          -3.720970D-01
                  3.372000D-01           6.242460D-01
                  1.232000D-01           5.517210D-01
            S    1   1.00
                  1.232000D-01           1.000000D+00
            S    1   1.00
                  0.0417000              1.0000000
            P    8   1.00
                  3.705000D+02           3.950050D-03
                  8.733000D+01           3.024920D-02
                  2.759000D+01           1.295540D-01
                  1.000000D+01           3.275940D-01
                  3.825000D+00           4.569920D-01
                  1.494000D+00           2.530860D-01
                  3.921000D-01           1.687980D-02
                  1.186000D-01          -2.070930D-03
            P    8   1.00
                  3.705000D+02          -9.598320D-04
                  8.733000D+01          -7.111770D-03
                  2.759000D+01          -3.271220D-02
                  1.000000D+01          -7.957840D-02
                  3.825000D+00          -1.350160D-01
                  1.494000D+00          -9.105850D-03
                  3.921000D-01           5.378020D-01
                  1.186000D-01           5.690660D-01
            P    1   1.00
                  1.186000D-01           1.000000D+00
            P    1   1.00
                  0.0343000              1.0000000
            D    1   1.00
                  3.730000D-01           1.0000000
            D    1   1.00
                  0.1130000              1.0000000
            ****
            -S     0
            S    12   1.00
                  1.108000D+05           2.476350D-04
                  1.661000D+04           1.920260D-03
                  3.781000D+03           9.961920D-03
                  1.071000D+03           4.029750D-02
                  3.498000D+02           1.286040D-01
                  1.263000D+02           3.034800D-01
                  4.926000D+01           4.214320D-01
                  2.016000D+01           2.307810D-01
                  5.720000D+00           1.789710D-02
                  2.182000D+00          -2.975160D-03
                  4.327000D-01           8.495220D-04
                  1.570000D-01          -3.679360D-04
            S    12   1.00
                  1.108000D+05          -6.870390D-05
                  1.661000D+04          -5.276810D-04
                  3.781000D+03          -2.796710D-03
                  1.071000D+03          -1.126510D-02
                  3.498000D+02          -3.888340D-02
                  1.263000D+02          -9.950250D-02
                  4.926000D+01          -1.997400D-01
                  2.016000D+01          -1.233600D-01
                  5.720000D+00           5.131940D-01
                  2.182000D+00           6.071200D-01
                  4.327000D-01           3.967530D-02
                  1.570000D-01          -9.468640D-03
            S    12   1.00
                  1.108000D+05           1.990770D-05
                  1.661000D+04           1.534830D-04
                  3.781000D+03           8.095030D-04
                  1.071000D+03           3.289740D-03
                  3.498000D+02           1.129670D-02
                  1.263000D+02           2.963850D-02
                  4.926000D+01           5.998510D-02
                  2.016000D+01           4.132480D-02
                  5.720000D+00          -2.074740D-01
                  2.182000D+00          -3.928890D-01
                  4.327000D-01           6.328400D-01
                  1.570000D-01           5.569240D-01
            S    1   1.00
                  1.570000D-01           1.000000D+00
            S    1   1.00
                  0.0507000              1.0000000
            P    8   1.00
                  3.997000D+02           4.475410D-03
                  9.419000D+01           3.417080D-02
                  2.975000D+01           1.442500D-01
                  1.077000D+01           3.539280D-01
                  4.119000D+00           4.590850D-01
                  1.625000D+00           2.063830D-01
                  4.726000D-01           1.021410D-02
                  1.407000D-01          -6.031220D-05
            P    8   1.00
                  3.997000D+02          -1.162510D-03
                  9.419000D+01          -8.656640D-03
                  2.975000D+01          -3.908860D-02
                  1.077000D+01          -9.346250D-02
                  4.119000D+00          -1.479940D-01
                  1.625000D+00           3.019040D-02
                  4.726000D-01           5.615730D-01
                  1.407000D-01           5.347760D-01
            P    1   1.00
                  1.407000D-01           1.000000D+00
            P    1   1.00
                  0.0399000              1.0000000
            D    1   1.00
                  4.790000D-01           1.0000000
            D    1   1.00
                  0.1520000              1.0000000
            ****
            -Cl     0
            S    12   1.00
                  1.279000D+05           2.411530D-04
                  1.917000D+04           1.870950D-03
                  4.363000D+03           9.708270D-03
                  1.236000D+03           3.931530D-02
                  4.036000D+02           1.259320D-01
                  1.457000D+02           2.993410D-01
                  5.681000D+01           4.218860D-01
                  2.323000D+01           2.372010D-01
                  6.644000D+00           1.915310D-02
                  2.575000D+00          -3.347920D-03
                  5.371000D-01           9.298830D-04
                  1.938000D-01          -3.963790D-04
            S    12   1.00
                  1.279000D+05          -6.789220D-05
                  1.917000D+04          -5.218360D-04
                  4.363000D+03          -2.765130D-03
                  1.236000D+03          -1.115370D-02
                  4.036000D+02          -3.859190D-02
                  1.457000D+02          -9.948480D-02
                  5.681000D+01          -2.013920D-01
                  2.323000D+01          -1.303130D-01
                  6.644000D+00           5.094430D-01
                  2.575000D+00           6.107250D-01
                  5.371000D-01           4.215490D-02
                  1.938000D-01          -9.234270D-03
            S    12   1.00
                  1.279000D+05           2.049860D-05
                  1.917000D+04           1.582980D-04
                  4.363000D+03           8.336390D-04
                  1.236000D+03           3.398800D-03
                  4.036000D+02           1.167380D-02
                  1.457000D+02           3.096220D-02
                  5.681000D+01           6.295330D-02
                  2.323000D+01           4.602570D-02
                  6.644000D+00          -2.193120D-01
                  2.575000D+00          -4.087730D-01
                  5.371000D-01           6.384650D-01
                  1.938000D-01           5.623620D-01
            S    1   1.00
                  1.938000D-01           1.000000D+00
            S    1   1.00
                  0.0608000              1.0000000
            P    8   1.00
                  4.176000D+02           5.259820D-03
                  9.833000D+01           3.983320D-02
                  3.104000D+01           1.646550D-01
                  1.119000D+01           3.873220D-01
                  4.249000D+00           4.570720D-01
                  1.624000D+00           1.516360D-01
                  5.322000D-01           1.816150D-03
                  1.620000D-01           1.882960D-03
            P    8   1.00
                  4.176000D+02          -1.435700D-03
                  9.833000D+01          -1.077960D-02
                  3.104000D+01          -4.700750D-02
                  1.119000D+01          -1.110300D-01
                  4.249000D+00          -1.532750D-01
                  1.624000D+00           8.946090D-02
                  5.322000D-01           5.794440D-01
                  1.620000D-01           4.832720D-01
            P    1   1.00
                  1.620000D-01           1.000000D+00
            P    1   1.00
                  0.0466000              1.0000000
            D    1   1.00
                  6.000000D-01           1.0000000
            D    1   1.00
                  0.1960000              1.0000000
            ****
            -Ar     0
            S    12   1.00
                  1.457000D+05           2.367000D-04
                  2.184000D+04           1.835230D-03
                  4.972000D+03           9.528600D-03
                  1.408000D+03           3.862830D-02
                  4.597000D+02           1.240810D-01
                  1.659000D+02           2.964710D-01
                  6.469000D+01           4.220680D-01
                  2.644000D+01           2.417110D-01
                  7.628000D+00           2.005090D-02
                  2.996000D+00          -3.610000D-03
                  6.504000D-01           9.756070D-04
                  2.337000D-01          -4.113160D-04
            S    12   1.00
                  1.457000D+05          -6.749100D-05
                  2.184000D+04          -5.185220D-04
                  4.972000D+03          -2.748250D-03
                  1.408000D+03          -1.110070D-02
                  4.597000D+02          -3.848200D-02
                  1.659000D+02          -9.975990D-02
                  6.469000D+01          -2.030880D-01
                  2.644000D+01          -1.356080D-01
                  7.628000D+00           5.071950D-01
                  2.996000D+00           6.128980D-01
                  6.504000D-01           4.429680D-02
                  2.337000D-01          -8.992780D-03
            S    12   1.00
                  1.457000D+05           2.104570D-05
                  2.184000D+04           1.625650D-04
                  4.972000D+03           8.554630D-04
                  1.408000D+03           3.497450D-03
                  4.597000D+02           1.201560D-02
                  1.659000D+02           3.213680D-02
                  6.469000D+01           6.552790D-02
                  2.644000D+01           4.993700D-02
                  7.628000D+00          -2.297690D-01
                  2.996000D+00          -4.210060D-01
                  6.504000D-01           6.423310D-01
                  2.337000D-01           5.675400D-01
            S    1   1.00
                  2.337000D-01           1.000000D+00
            S    1   1.00
                  0.0709000              1.0000000
            P    8   1.00
                  4.537000D+02           5.705550D-03
                  1.068000D+02           4.304600D-02
                  3.373000D+01           1.765910D-01
                  1.213000D+01           4.068630D-01
                  4.594000D+00           4.525490D-01
                  1.678000D+00           1.228010D-01
                  5.909000D-01          -4.459960D-03
                  1.852000D-01           2.052250D-03
            P    8   1.00
                  4.537000D+02          -1.606550D-03
                  1.068000D+02          -1.217140D-02
                  3.373000D+01          -5.207890D-02
                  1.213000D+01          -1.237370D-01
                  4.594000D+00          -1.516190D-01
                  1.678000D+00           1.424250D-01
                  5.909000D-01           5.845010D-01
                  1.852000D-01           4.375400D-01
            P    1   1.00
                  1.852000D-01           1.000000D+00
            P    1   1.00
                  0.0533000              1.0000000
            D    1   1.00
                  7.380000D-01           1.0000000
            D    1   1.00
                  0.2400000              1.0000000
            ****
            -Sc     0
            S    20   1.00
                  2.715278D+06           8.147221D-06
                  4.065984D+05           6.334788D-05
                  9.253004D+04           3.330384D-04
                  2.620792D+04           1.404055D-03
                  8.549429D+03           5.081725D-03
                  3.085975D+03           1.626926D-02
                  1.203172D+03           4.624577D-02
                  4.984869D+02           1.137223D-01
                  2.167360D+02           2.257636D-01
                  9.787476D+01           3.106700D-01
                  4.520433D+01           2.191906D-01
                  2.021187D+01           7.215879D-02
                  9.574751D+00           1.187030D-01
                  4.540346D+00           1.220532D-01
                  1.995687D+00           2.136795D-02
                  9.422150D-01          -5.357246D-04
                  4.178450D-01           2.435774D-04
                  9.576100D-02          -8.796617D-05
                  5.135100D-02           7.878246D-05
                  2.387800D-02          -1.637155D-05
            S    20   1.00
                  2.715278D+06          -4.722109D-06
                  4.065984D+05          -3.671829D-05
                  9.253004D+04          -1.930883D-04
                  2.620792D+04          -8.146870D-04
                  8.549429D+03          -2.955526D-03
                  3.085975D+03          -9.520035D-03
                  1.203172D+03          -2.746858D-02
                  4.984869D+02          -6.991528D-02
                  2.167360D+02          -1.499251D-01
                  9.787476D+01          -2.459153D-01
                  4.520433D+01          -2.401293D-01
                  2.021187D+01           3.567987D-02
                  9.574751D+00           4.915023D-01
                  4.540346D+00           4.911381D-01
                  1.995687D+00           9.120633D-02
                  9.422150D-01          -5.356723D-03
                  4.178450D-01           8.812836D-04
                  9.576100D-02          -7.605536D-04
                  5.135100D-02           6.340116D-04
                  2.387800D-02          -1.556163D-04
            S    20   1.00
                  2.715278D+06           9.139905D-07
                  4.065984D+05           7.108513D-06
                  9.253004D+04           3.738126D-05
                  2.620792D+04           1.578828D-04
                  8.549429D+03           5.737686D-04
                  3.085975D+03           1.859244D-03
                  1.203172D+03           5.433182D-03
                  4.984869D+02           1.425387D-02
                  2.167360D+02           3.246144D-02
                  9.787476D+01           6.003454D-02
                  4.520433D+01           6.916105D-02
                  2.021187D+01          -2.113084D-02
                  9.574751D+00          -2.666832D-01
                  4.540346D+00          -4.367591D-01
                  1.995687D+00           6.498243D-02
                  9.422150D-01           7.009599D-01
                  4.178450D-01           4.515562D-01
                  9.576100D-02           3.011910D-02
                  5.135100D-02          -1.329480D-02
                  2.387800D-02           4.633679D-03
            S    20   1.00
                  2.715278D+06          -2.201951D-07
                  4.065984D+05          -1.711419D-06
                  9.253004D+04          -9.008469D-06
                  2.620792D+04          -3.799997D-05
                  8.549429D+03          -1.383227D-04
                  3.085975D+03          -4.473692D-04
                  1.203172D+03          -1.310691D-03
                  4.984869D+02          -3.429860D-03
                  2.167360D+02          -7.847579D-03
                  9.787476D+01          -1.447189D-02
                  4.520433D+01          -1.690669D-02
                  2.021187D+01           5.396115D-03
                  9.574751D+00           6.671062D-02
                  4.540346D+00           1.178356D-01
                  1.995687D+00          -2.738134D-02
                  9.422150D-01          -2.260149D-01
                  4.178450D-01          -3.073539D-01
                  9.576100D-02           2.544054D-01
                  5.135100D-02           5.981590D-01
                  2.387800D-02           3.115202D-01
            S    20   1.00
                  2.715278D+06          -3.757238D-07
                  4.065984D+05          -2.981907D-06
                  9.253004D+04          -1.522586D-05
                  2.620792D+04          -6.684686D-05
                  8.549429D+03          -2.313129D-04
                  3.085975D+03          -7.959729D-04
                  1.203172D+03          -2.161961D-03
                  4.984869D+02          -6.206459D-03
                  2.167360D+02          -1.261905D-02
                  9.787476D+01          -2.739459D-02
                  4.520433D+01          -2.336516D-02
                  2.021187D+01          -5.734627D-03
                  9.574751D+00           1.536025D-01
                  4.540346D+00           1.447100D-01
                  1.995687D+00           9.359699D-02
                  9.422150D-01          -8.687730D-01
                  4.178450D-01           2.114597D-02
                  9.576100D-02           2.275498D+00
                  5.135100D-02          -1.190770D+00
                  2.387800D-02          -7.674257D-01
            S    1   1.00
                  2.387800D-02           1.000000D+00
            S    1   1.00
                  1.110000D-02           1.000000D+00
            P    16   1.00
                  1.059219D+04           4.500000D-05
                  2.507533D+03           4.010000D-04
                  8.144571D+02           2.302000D-03
                  3.115195D+02           1.003700D-02
                  1.319617D+02           3.495400D-02
                  5.998718D+01           9.790900D-02
                  2.866250D+01           2.106800D-01
                  1.410851D+01           3.300930D-01
                  7.103706D+00           3.310270D-01
                  3.609200D+00           1.579600D-01
                  1.776070D+00           2.209900D-02
                  8.547600D-01          -1.605000D-03
                  4.022390D-01          -1.326000D-03
                  1.546650D-01          -2.800000D-04
                  6.494500D-02           3.400000D-05
                  2.635900D-02          -1.300000D-05
            P    16   1.00
                  1.059219D+04          -1.500000D-05
                  2.507533D+03          -1.310000D-04
                  8.144571D+02          -7.570000D-04
                  3.115195D+02          -3.318000D-03
                  1.319617D+02          -1.170600D-02
                  5.998718D+01          -3.360400D-02
                  2.866250D+01          -7.487900D-02
                  1.410851D+01          -1.225480D-01
                  7.103706D+00          -1.302760D-01
                  3.609200D+00           1.459600D-02
                  1.776070D+00           3.091840D-01
                  8.547600D-01           4.629980D-01
                  4.022390D-01           3.049570D-01
                  1.546650D-01           5.087800D-02
                  6.494500D-02          -4.493000D-03
                  2.635900D-02           1.832000D-03
            P    16   1.00
                  1.059219D+04          -4.000000D-06
                  2.507533D+03          -3.200000D-05
                  8.144571D+02          -1.850000D-04
                  3.115195D+02          -8.080000D-04
                  1.319617D+02          -2.870000D-03
                  5.998718D+01          -8.207000D-03
                  2.866250D+01          -1.847300D-02
                  1.410851D+01          -3.010100D-02
                  7.103706D+00          -3.294300D-02
                  3.609200D+00           7.958000D-03
                  1.776070D+00           8.799300D-02
                  8.547600D-01           1.523770D-01
                  4.022390D-01           9.717000D-02
                  1.546650D-01          -2.569380D-01
                  6.494500D-02          -5.878150D-01
                  2.635900D-02          -3.054210D-01
            P    16   1.00
                  1.059219D+04           4.000000D-06
                  2.507533D+03           3.900000D-05
                  8.144571D+02           2.210000D-04
                  3.115195D+02           9.840000D-04
                  1.319617D+02           3.423000D-03
                  5.998718D+01           9.993000D-03
                  2.866250D+01           2.191600D-02
                  1.410851D+01           3.700800D-02
                  7.103706D+00           3.779400D-02
                  3.609200D+00          -4.379000D-03
                  1.776070D+00          -1.101640D-01
                  8.547600D-01          -1.610170D-01
                  4.022390D-01          -1.824820D-01
                  1.546650D-01           3.886110D-01
                  6.494500D-02           6.911000D-01
                  2.635900D-02           7.960400D-02
            P    1   1.00
                  2.635900D-02           1.000000D+00
            P    1   1.00
                  1.066000D-02           1.000000D+00
            D    8   1.00
                  5.051380D+01           4.266000D-03
                  1.474050D+01           2.770800D-02
                  5.195000D+00           1.000010D-01
                  2.028460D+00           2.315810D-01
                  8.040860D-01           3.460330D-01
                  3.076890D-01           3.733740D-01
                  1.113920D-01           2.642880D-01
                  3.735200D-02           6.366700D-02
            D    8   1.00
                  5.051380D+01          -4.389000D-03
                  1.474050D+01          -2.836300D-02
                  5.195000D+00          -1.051370D-01
                  2.028460D+00          -2.348540D-01
                  8.040860D-01          -3.246090D-01
                  3.076890D-01          -6.428900D-02
                  1.113920D-01           6.017490D-01
                  3.735200D-02           3.903000D-01
            D    1   1.00
                  3.735200D-02           1.000000D+00
            D    1   1.00
                  1.244000D-02           1.000000D+00
            F    2   1.00
                  7.126000D-01           3.617450D-01
                  1.636000D-01           8.218680D-01
            F    1   1.00
                  4.063000D-02           1.000000D+00
            ****
            -Ti     0
            S    20   1.00
                  3.014643D+06           8.060782D-06
                  4.514329D+05           6.267518D-05
                  1.027338D+05           3.295006D-04
                  2.909817D+04           1.389203D-03
                  9.492330D+03           5.028469D-03
                  3.426346D+03           1.610419D-02
                  1.335896D+03           4.581232D-02
                  5.535026D+02           1.128613D-01
                  2.406925D+02           2.248193D-01
                  1.087293D+02           3.114571D-01
                  5.026457D+01           2.224995D-01
                  2.258004D+01           7.293128D-02
                  1.071432D+01           1.160683D-01
                  5.093546D+00           1.194774D-01
                  2.244183D+00           2.097868D-02
                  1.059570D+00          -5.091715D-04
                  4.688490D-01           2.217859D-04
                  1.061430D-01          -7.636896D-05
                  5.526200D-02           7.719539D-05
                  2.546500D-02          -1.149056D-05
            S    20   1.00
                  3.014643D+06          -4.630486D-06
                  4.514329D+05          -3.600451D-05
                  1.027338D+05          -1.893420D-04
                  2.909817D+04          -7.988781D-04
                  9.492330D+03          -2.898698D-03
                  3.426346D+03          -9.339701D-03
                  1.335896D+03          -2.697464D-02
                  5.535026D+02          -6.878913D-02
                  2.406925D+02          -1.481037D-01
                  1.087293D+02          -2.445253D-01
                  5.026457D+01          -2.419916D-01
                  2.258004D+01           3.183790D-02
                  1.071432D+01           4.932686D-01
                  5.093546D+00           4.939655D-01
                  2.244183D+00           9.196313D-02
                  1.059570D+00          -5.316992D-03
                  4.688490D-01           8.085624D-04
                  1.061430D-01          -6.918459D-04
                  5.526200D-02           6.086512D-04
                  2.546500D-02          -1.313842D-04
            S    20   1.00
                  3.014643D+06           9.230559D-07
                  4.514329D+05           7.178974D-06
                  1.027338D+05           3.775134D-05
                  2.909817D+04           1.594532D-04
                  9.492330D+03           5.795150D-04
                  3.426346D+03           1.878414D-03
                  1.335896D+03           5.492747D-03
                  5.535026D+02           1.443297D-02
                  2.406925D+02           3.296408D-02
                  1.087293D+02           6.125493D-02
                  5.026457D+01           7.134113D-02
                  2.258004D+01          -1.973150D-02
                  1.071432D+01          -2.741869D-01
                  5.093546D+00          -4.440977D-01
                  2.244183D+00           7.776084D-02
                  1.059570D+00           7.068444D-01
                  4.688490D-01           4.413892D-01
                  1.061430D-01           2.799769D-02
                  5.526200D-02          -1.210790D-02
                  2.546500D-02           4.324762D-03
            S    20   1.00
                  3.014643D+06          -2.180323D-07
                  4.514329D+05          -1.694860D-06
                  1.027338D+05          -8.919208D-06
                  2.909817D+04          -3.763633D-05
                  9.492330D+03          -1.369575D-04
                  3.426346D+03          -4.432894D-04
                  1.335896D+03          -1.298868D-03
                  5.535026D+02          -3.406752D-03
                  2.406925D+02          -7.810829D-03
                  1.087293D+02          -1.449245D-02
                  5.026457D+01          -1.708136D-02
                  2.258004D+01           4.897666D-03
                  1.071432D+01           6.753108D-02
                  5.093546D+00           1.173318D-01
                  2.244183D+00          -2.985025D-02
                  1.059570D+00          -2.277634D-01
                  4.688490D-01          -2.928115D-01
                  1.061430D-01           2.665300D-01
                  5.526200D-02           5.912406D-01
                  2.546500D-02           3.037229D-01
            S    20   1.00
                  3.014643D+06          -3.975126D-07
                  4.514329D+05          -3.161080D-06
                  1.027338D+05          -1.609375D-05
                  2.909817D+04          -7.092947D-05
                  9.492330D+03          -2.442710D-04
                  3.426346D+03          -8.457892D-04
                  1.335896D+03          -2.282208D-03
                  5.535026D+02          -6.619873D-03
                  2.406925D+02          -1.335024D-02
                  1.087293D+02          -2.955830D-02
                  5.026457D+01          -2.477039D-02
                  2.258004D+01          -8.414624D-03
                  1.071432D+01           1.693855D-01
                  5.093546D+00           1.500787D-01
                  2.244183D+00           9.787777D-02
                  1.059570D+00          -9.653608D-01
                  4.688490D-01           1.489721D-01
                  1.061430D-01           2.191179D+00
                  5.526200D-02          -1.243325D+00
                  2.546500D-02          -6.711916D-01
            S    1   1.00
                  2.546500D-02           1.000000D+00
            S    1   1.00
                  1.173000D-02           1.000000D+00
            P    16   1.00
                  1.191203D+04           4.400000D-05
                  2.819947D+03           3.910000D-04
                  9.159479D+02           2.248000D-03
                  3.503842D+02           9.823000D-03
                  1.484825D+02           3.433800D-02
                  6.753944D+01           9.666600D-02
                  3.230332D+01           2.094170D-01
                  1.592786D+01           3.301890D-01
                  8.038035D+00           3.319360D-01
                  4.093916D+00           1.584880D-01
                  2.022390D+00           2.231000D-02
                  9.761020D-01          -1.566000D-03
                  4.595950D-01          -1.324000D-03
                  1.771520D-01          -2.710000D-04
                  7.351700D-02           3.200000D-05
                  2.940100D-02          -1.200000D-05
            P    16   1.00
                  1.191203D+04          -1.500000D-05
                  2.819947D+03          -1.310000D-04
                  9.159479D+02          -7.550000D-04
                  3.503842D+02          -3.319000D-03
                  1.484825D+02          -1.175000D-02
                  6.753944D+01          -3.392200D-02
                  3.230332D+01          -7.616400D-02
                  1.592786D+01          -1.257020D-01
                  8.038035D+00          -1.330980D-01
                  4.093916D+00           1.740600D-02
                  2.022390D+00           3.151650D-01
                  9.761020D-01           4.618140D-01
                  4.595950D-01           2.998560D-01
                  1.771520D-01           5.000000D-02
                  7.351700D-02          -4.230000D-03
                  2.940100D-02           1.725000D-03
            P    16   1.00
                  1.191203D+04           4.000000D-06
                  2.819947D+03           3.100000D-05
                  9.159479D+02           1.820000D-04
                  3.503842D+02           7.950000D-04
                  1.484825D+02           2.833000D-03
                  6.753944D+01           8.154000D-03
                  3.230332D+01           1.847200D-02
                  1.592786D+01           3.040000D-02
                  8.038035D+00           3.304700D-02
                  4.093916D+00          -8.251000D-03
                  2.022390D+00          -8.855400D-02
                  9.761020D-01          -1.496120D-01
                  4.595950D-01          -9.422700D-02
                  1.771520D-01           2.508460D-01
                  7.351700D-02           5.866430D-01
                  2.940100D-02           3.135350D-01
            P    16   1.00
                  1.191203D+04           4.000000D-06
                  2.819947D+03           3.900000D-05
                  9.159479D+02           2.230000D-04
                  3.503842D+02           9.920000D-04
                  1.484825D+02           3.476000D-03
                  6.753944D+01           1.017200D-02
                  3.230332D+01           2.257600D-02
                  1.592786D+01           3.823800D-02
                  8.038035D+00           3.933700D-02
                  4.093916D+00          -6.106000D-03
                  2.022390D+00          -1.129620D-01
                  9.761020D-01          -1.681140D-01
                  4.595950D-01          -1.659320D-01
                  1.771520D-01           3.914030D-01
                  7.351700D-02           6.818400D-01
                  2.940100D-02           8.403100D-02
            P    1   1.00
                  2.940100D-02           1.000000D+00
            P    1   1.00
                  1.176000D-02           1.000000D+00
            D    8   1.00
                  6.401300D+01           3.887000D-03
                  1.881790D+01           2.639900D-02
                  6.728700D+00           9.751100D-02
                  2.664130D+00           2.328480D-01
                  1.078680D+00           3.531520D-01
                  4.232090D-01           3.721860D-01
                  1.559990D-01           2.476720D-01
                  5.188400D-02           5.823600D-02
            D    8   1.00
                  6.401300D+01          -3.970000D-03
                  1.881790D+01          -2.687300D-02
                  6.728700D+00          -1.022750D-01
                  2.664130D+00          -2.377280D-01
                  1.078680D+00          -3.121140D-01
                  4.232090D-01          -4.237800D-02
                  1.559990D-01           5.886580D-01
                  5.188400D-02           4.103020D-01
            D    1   1.00
                  5.188400D-02           1.000000D+00
            D    1   1.00
                  1.726000D-02           1.000000D+00
            F    2   1.00
                  1.227400D+00           3.581580D-01
                  2.788000D-01           8.257940D-01
            F    1   1.00
                  8.266000D-02           1.000000D+00
            ****
            -V     0
            S    20   1.00
                  3.321857D+06           8.039999D-06
                  4.974356D+05           6.251402D-05
                  1.132027D+05           3.286553D-04
                  3.206333D+04           1.385697D-03
                  1.045962D+04           5.016217D-03
                  3.775506D+03           1.606931D-02
                  1.472040D+03           4.574242D-02
                  6.099331D+02           1.128544D-01
                  2.652634D+02           2.254344D-01
                  1.198607D+02           3.140461D-01
                  5.544891D+01           2.267819D-01
                  2.498372D+01           7.334069D-02
                  1.188056D+01           1.102474D-01
                  5.660311D+00           1.131358D-01
                  2.495703D+00           1.971295D-02
                  1.177866D+00          -4.719088D-04
                  5.200440D-01           1.861606D-04
                  1.159650D-01          -6.208598D-05
                  5.893800D-02           7.295314D-05
                  2.694600D-02          -6.362062D-06
            S    20   1.00
                  3.321857D+06          -4.503003D-06
                  4.974356D+05          -3.501295D-05
                  1.132027D+05          -1.841339D-04
                  3.206333D+04          -7.769216D-04
                  1.045962D+04          -2.819505D-03
                  3.775506D+03          -9.087486D-03
                  1.472040D+03          -2.627134D-02
                  6.099331D+02          -6.712726D-02
                  2.652634D+02          -1.451130D-01
                  1.198607D+02          -2.412483D-01
                  5.544891D+01          -2.416314D-01
                  2.498372D+01           3.067362D-02
                  1.188056D+01           4.970415D-01
                  5.660311D+00           4.958875D-01
                  2.495703D+00           9.181868D-02
                  1.177866D+00          -5.392514D-03
                  5.200440D-01           7.102380D-04
                  1.159650D-01          -6.363128D-04
                  5.893800D-02           5.979932D-04
                  2.694600D-02          -1.100879D-04
            S    20   1.00
                  3.321857D+06           9.320648D-07
                  4.974356D+05           7.249306D-06
                  1.132027D+05           3.811967D-05
                  3.206333D+04           1.610238D-04
                  1.045962D+04           5.852210D-04
                  3.775506D+03           1.897502D-03
                  1.472040D+03           5.550909D-03
                  6.099331D+02           1.460584D-02
                  2.652634D+02           3.342974D-02
                  1.198607D+02           6.235722D-02
                  5.544891D+01           7.312435D-02
                  2.498372D+01          -1.911472D-02
                  1.188056D+01          -2.817249D-01
                  5.660311D+00          -4.488151D-01
                  2.495703D+00           9.202696D-02
                  1.177866D+00           7.110117D-01
                  5.200440D-01           4.309274D-01
                  1.159650D-01           2.604589D-02
                  5.893800D-02          -1.101049D-02
                  2.694600D-02           4.106300D-03
            S    20   1.00
                  3.321857D+06          -2.158944D-07
                  4.974356D+05          -1.678519D-06
                  1.132027D+05          -8.831213D-06
                  3.206333D+04          -3.727769D-05
                  1.045962D+04          -1.356099D-04
                  3.775506D+03          -4.392351D-04
                  1.472040D+03          -1.286948D-03
                  6.099331D+02          -3.382149D-03
                  2.652634D+02          -7.765646D-03
                  1.198607D+02          -1.447985D-02
                  5.544891D+01          -1.715502D-02
                  2.498372D+01           4.610101D-03
                  1.188056D+01           6.827831D-02
                  5.660311D+00           1.161368D-01
                  2.495703D+00          -3.277049D-02
                  1.177866D+00          -2.280000D-01
                  5.200440D-01          -2.793991D-01
                  1.159650D-01           2.771165D-01
                  5.893800D-02           5.852999D-01
                  2.694600D-02           2.963946D-01
            S    20   1.00
                  3.321857D+06          -4.093416D-07
                  4.974356D+05          -3.258956D-06
                  1.132027D+05          -1.656390D-05
                  3.206333D+04          -7.316689D-05
                  1.045962D+04          -2.512784D-04
                  3.775506D+03          -8.732657D-04
                  1.472040D+03          -2.347654D-03
                  6.099331D+02          -6.853150D-03
                  2.652634D+02          -1.376420D-02
                  1.198607D+02          -3.084679D-02
                  5.544891D+01          -2.562208D-02
                  2.498372D+01          -1.005123D-02
                  1.188056D+01           1.795330D-01
                  5.660311D+00           1.522400D-01
                  2.495703D+00           9.483887D-02
                  1.177866D+00          -1.014876D+00
                  5.200440D-01           2.308810D-01
                  1.159650D-01           2.113321D+00
                  5.893800D-02          -1.253048D+00
                  2.694600D-02          -6.139502D-01
            S    1   1.00
                  2.694600D-02           1.000000D+00
            S    1   1.00
                  1.232000D-02           1.000000D+00
            P    16   1.00
                  1.327320D+04           4.300000D-05
                  3.142126D+03           3.840000D-04
                  1.020588D+03           2.210000D-03
                  3.904407D+02           9.678000D-03
                  1.655043D+02           3.393600D-02
                  7.532006D+01           9.591700D-02
                  3.605503D+01           2.088530D-01
                  1.780436D+01           3.306600D-01
                  9.002929D+00           3.323120D-01
                  4.594544D+00           1.581880D-01
                  2.276760D+00           2.225200D-02
                  1.101178D+00          -1.565000D-03
                  5.186380D-01          -1.353000D-03
                  2.005650D-01          -2.650000D-04
                  8.129100D-02           2.900000D-05
                  3.179500D-02          -1.100000D-05
            P    16   1.00
                  1.327320D+04          -1.500000D-05
                  3.142126D+03          -1.310000D-04
                  1.020588D+03          -7.550000D-04
                  3.904407D+02          -3.325000D-03
                  1.655043D+02          -1.181100D-02
                  7.532006D+01          -3.425600D-02
                  3.605503D+01          -7.736300D-02
                  1.780436D+01          -1.284560D-01
                  9.002929D+00          -1.350780D-01
                  4.594544D+00           2.083800D-02
                  2.276760D+00           3.204990D-01
                  1.101178D+00           4.602600D-01
                  5.186380D-01           2.953460D-01
                  2.005650D-01           4.904600D-02
                  8.129100D-02          -3.824000D-03
                  3.179500D-02           1.585000D-03
            P    16   1.00
                  1.327320D+04           4.000000D-06
                  3.142126D+03           3.200000D-05
                  1.020588D+03           1.830000D-04
                  3.904407D+02           8.020000D-04
                  1.655043D+02           2.862000D-03
                  7.532006D+01           8.287000D-03
                  3.605503D+01           1.887000D-02
                  1.780436D+01           3.130700D-02
                  9.002929D+00           3.366000D-02
                  4.594544D+00          -9.479000D-03
                  2.276760D+00          -9.231300D-02
                  1.101178D+00          -1.489890D-01
                  5.186380D-01          -8.364400D-02
                  2.005650D-01           2.493390D-01
                  8.129100D-02           5.805150D-01
                  3.179500D-02           3.223800D-01
            P    16   1.00
                  1.327320D+04           4.000000D-06
                  3.142126D+03           3.900000D-05
                  1.020588D+03           2.230000D-04
                  3.904407D+02           9.960000D-04
                  1.655043D+02           3.498000D-03
                  7.532006D+01           1.029600D-02
                  3.605503D+01           2.296200D-02
                  1.780436D+01           3.920800D-02
                  9.002929D+00           3.994300D-02
                  4.594544D+00          -7.121000D-03
                  2.276760D+00          -1.162250D-01
                  1.101178D+00          -1.694960D-01
                  5.186380D-01          -1.553740D-01
                  2.005650D-01           3.950220D-01
                  8.129100D-02           6.789080D-01
                  3.179500D-02           8.312200D-02
            P    1   1.00
                  3.179500D-02           1.000000D+00
            P    1   1.00
                  1.244000D-02           1.000000D+00
            D    8   1.00
                  7.761150D+01           3.595000D-03
                  2.291590D+01           2.521000D-02
                  8.279540D+00           9.478600D-02
                  3.309930D+00           2.303630D-01
                  1.358630D+00           3.528940D-01
                  5.413500D-01           3.704140D-01
                  2.023560D-01           2.457180D-01
                  6.756800D-02           6.099300D-02
            D    8   1.00
                  7.761150D+01          -3.818000D-03
                  2.291590D+01          -2.671700D-02
                  8.279540D+00          -1.036900D-01
                  3.309930D+00          -2.476890D-01
                  1.358630D+00          -3.115230D-01
                  5.413500D-01          -2.282700D-02
                  2.023560D-01           5.697260D-01
                  6.756800D-02           4.194930D-01
            D    1   1.00
                  6.756800D-02           1.000000D+00
            D    1   1.00
                  2.256000D-02           1.000000D+00
            F    2   1.00
                  1.748800D+00           3.900680D-01
                  4.057000D-01           8.008410D-01
            F    1   1.00
                  1.311200D-01           1.000000D+00
            ****
            -Cr     0
            S    20   1.00
                  6.177194D+06           4.128667D-06
                  9.249295D+05           3.210767D-05
                  2.104865D+05           1.688416D-04
                  5.962005D+04           7.128520D-04
                  1.945076D+04           2.589325D-03
                  7.022056D+03           8.377350D-03
                  2.738763D+03           2.441725D-02
                  1.135814D+03           6.365135D-02
                  4.950923D+02           1.427618D-01
                  2.247487D+02           2.541275D-01
                  1.053836D+02           3.009512D-01
                  5.019359D+01           1.766513D-01
                  2.224957D+01           6.936709D-02
                  1.098265D+01           1.179579D-01
                  5.383665D+00           8.916187D-02
                  2.343685D+00           1.103630D-02
                  1.105202D+00          -3.546048D-04
                  4.878480D-01           1.057311D-04
                  8.959900D-02           1.114640D-05
                  3.342300D-02           2.661387D-05
            S    20   1.00
                  6.177194D+06          -2.301772D-06
                  9.249295D+05          -1.789536D-05
                  2.104865D+05          -9.416174D-05
                  5.962005D+04          -3.975074D-04
                  1.945076D+04          -1.447025D-03
                  7.022056D+03          -4.694622D-03
                  2.738763D+03          -1.382387D-02
                  1.135814D+03          -3.674643D-02
                  4.950923D+02          -8.647185D-02
                  2.247487D+02          -1.696735D-01
                  1.053836D+02          -2.507089D-01
                  5.019359D+01          -1.961156D-01
                  2.224957D+01           1.457244D-01
                  1.098265D+01           5.466706D-01
                  5.383665D+00           3.979434D-01
                  2.343685D+00           5.277007D-02
                  1.105202D+00          -4.374537D-03
                  4.878480D-01           3.204035D-04
                  8.959900D-02          -5.142077D-05
                  3.342300D-02           1.584134D-04
            S    20   1.00
                  6.177194D+06           4.862957D-07
                  9.249295D+05           3.776645D-06
                  2.104865D+05           1.990664D-05
                  5.962005D+04           8.389164D-05
                  1.945076D+04           3.065706D-04
                  7.022056D+03           9.944107D-04
                  2.738763D+03           2.961959D-03
                  1.135814D+03           7.969473D-03
                  4.950923D+02           1.955017D-02
                  2.247487D+02           4.085035D-02
                  1.053836D+02           6.929003D-02
                  5.019359D+01           6.146984D-02
                  2.224957D+01          -6.981302D-02
                  1.098265D+01          -3.517597D-01
                  5.383665D+00          -3.828629D-01
                  2.343685D+00           2.676401D-01
                  1.105202D+00           7.175950D-01
                  4.878480D-01           3.020814D-01
                  8.959900D-02           7.749514D-03
                  3.342300D-02           2.696096D-04
            S    20   1.00
                  6.177194D+06          -1.102451D-07
                  9.249295D+05          -8.530233D-07
                  2.104865D+05          -4.520358D-06
                  5.962005D+04          -1.891612D-05
                  1.945076D+04          -6.974344D-05
                  7.022056D+03          -2.237867D-04
                  2.738763D+03          -6.754503D-04
                  1.135814D+03          -1.789346D-03
                  4.950923D+02          -4.477858D-03
                  2.247487D+02          -9.140144D-03
                  1.053836D+02          -1.610562D-02
                  5.019359D+01          -1.334870D-02
                  2.224957D+01           1.426027D-02
                  1.098265D+01           8.931690D-02
                  5.383665D+00           8.885279D-02
                  2.343685D+00          -6.368776D-02
                  1.105202D+00          -2.783262D-01
                  4.878480D-01          -1.830071D-01
                  8.959900D-02           6.790937D-01
                  3.342300D-02           4.672953D-01
            S    20   1.00
                  6.177194D+06           2.179893D-07
                  9.249295D+05           1.612940D-06
                  2.104865D+05           9.111842D-06
                  5.962005D+04           3.500645D-05
                  1.945076D+04           1.435315D-04
                  7.022056D+03           4.035896D-04
                  2.738763D+03           1.425177D-03
                  1.135814D+03           3.114009D-03
                  4.950923D+02           9.814449D-03
                  2.247487D+02           1.474698D-02
                  1.053836D+02           3.911512D-02
                  5.019359D+01           9.170888D-03
                  2.224957D+01           1.559878D-02
                  1.098265D+01          -2.816844D-01
                  5.383665D+00          -6.895261D-03
                  2.343685D+00          -1.769781D-01
                  1.105202D+00           1.443061D+00
                  4.878480D-01          -1.029318D+00
                  8.959900D-02          -1.307667D+00
                  3.342300D-02           1.503842D+00
            S    1   1.00
                  3.342300D-02           1.000000D+00
            S    1   1.00
                  1.247000D-02           1.000000D+00
            P    16   1.00
                  1.445420D+04           4.400000D-05
                  3.421676D+03           3.890000D-04
                  1.111387D+03           2.241000D-03
                  4.251918D+02           9.821000D-03
                  1.802623D+02           3.447100D-02
                  8.206117D+01           9.746000D-02
                  3.929726D+01           2.119850D-01
                  1.941959D+01           3.339900D-01
                  9.828899D+00           3.301370D-01
                  5.016810D+00           1.522270D-01
                  2.487091D+00           2.042500D-02
                  1.198780D+00          -1.360000D-03
                  5.586950D-01          -1.195000D-03
                  2.089240D-01          -1.970000D-04
                  8.460800D-02           2.300000D-05
                  3.325800D-02          -9.000000D-06
            P    16   1.00
                  1.445420D+04          -1.500000D-05
                  3.421676D+03          -1.350000D-04
                  1.111387D+03          -7.770000D-04
                  4.251918D+02          -3.427000D-03
                  1.802623D+02          -1.218900D-02
                  8.206117D+01          -3.538800D-02
                  3.929726D+01          -7.991500D-02
                  1.941959D+01          -1.323350D-01
                  9.828899D+00          -1.354010D-01
                  5.016810D+00           3.200800D-02
                  2.487091D+00           3.338490D-01
                  1.198780D+00           4.617730D-01
                  5.586950D-01           2.812900D-01
                  2.089240D-01           4.184300D-02
                  8.460800D-02          -4.002000D-03
                  3.325800D-02           1.521000D-03
            P    16   1.00
                  1.445420D+04           4.000000D-06
                  3.421676D+03           3.200000D-05
                  1.111387D+03           1.850000D-04
                  4.251918D+02           8.100000D-04
                  1.802623D+02           2.906000D-03
                  8.206117D+01           8.391000D-03
                  3.929726D+01           1.919300D-02
                  1.941959D+01           3.156400D-02
                  9.828899D+00           3.341700D-02
                  5.016810D+00          -1.290700D-02
                  2.487091D+00          -9.365900D-02
                  1.198780D+00          -1.499770D-01
                  5.586950D-01          -6.723400D-02
                  2.089240D-01           2.707590D-01
                  8.460800D-02           5.758070D-01
                  3.325800D-02           3.011210D-01
            P    16   1.00
                  1.445420D+04           4.000000D-06
                  3.421676D+03           4.000000D-05
                  1.111387D+03           2.290000D-04
                  4.251918D+02           1.019000D-03
                  1.802623D+02           3.602000D-03
                  8.206117D+01           1.055000D-02
                  3.929726D+01           2.370200D-02
                  1.941959D+01           3.998800D-02
                  9.828899D+00           4.043700D-02
                  5.016810D+00          -1.207400D-02
                  2.487091D+00          -1.189390D-01
                  1.198780D+00          -1.781000D-01
                  5.586950D-01          -1.238650D-01
                  2.089240D-01           4.297220D-01
                  8.460800D-02           6.507860D-01
                  3.325800D-02           6.417100D-02
            P    1   1.00
                  3.325800D-02           1.000000D+00
            P    1   1.00
                  1.307000D-02           1.000000D+00
            D    8   1.00
                  8.857680D+01           3.621000D-03
                  2.620450D+01           2.576600D-02
                  9.517470D+00           9.755600D-02
                  3.822480D+00           2.363120D-01
                  1.575120D+00           3.582860D-01
                  6.289280D-01           3.685430D-01
                  2.344240D-01           2.354940D-01
                  7.681500D-02           5.315600D-02
            D    8   1.00
                  8.857680D+01          -4.122000D-03
                  2.620450D+01          -2.930700D-02
                  9.517470D+00          -1.150620D-01
                  3.822480D+00          -2.730680D-01
                  1.575120D+00          -3.144230D-01
                  6.289280D-01           4.209700D-02
                  2.344240D-01           5.914030D-01
                  7.681500D-02           3.582150D-01
            D    1   1.00
                  7.681500D-02           1.000000D+00
            D    1   1.00
                  2.517000D-02           1.000000D+00
            F    2   1.00
                  2.221100D+00           4.235450D-01
                  5.231000D-01           7.741140D-01
            F    1   1.00
                  1.763600D-01           1.000000D+00
            ****
            -Mn     0
            S    20   1.00
                  3.960805D+06           8.242127D-06
                  5.931155D+05           6.408587D-05
                  1.349768D+05           3.369253D-04
                  3.823067D+04           1.420648D-03
                  1.247154D+04           5.143683D-03
                  4.501743D+03           1.648569D-02
                  1.755212D+03           4.698560D-02
                  7.273039D+02           1.162437D-01
                  3.163678D+02           2.335277D-01
                  1.430098D+02           3.292837D-01
                  6.621805D+01           2.440304D-01
                  2.991896D+01           7.219806D-02
                  1.430318D+01           7.687806D-02
                  6.839451D+00           7.852235D-02
                  3.012374D+00           1.294109D-02
                  1.418808D+00          -3.784873D-04
                  6.236240D-01          -2.503203D-05
                  1.340980D-01          -2.421517D-05
                  6.554800D-02           3.462071D-05
                  2.958400D-02           4.261482D-07
            S    20   1.00
                  3.960805D+06          -3.936095D-06
                  5.931155D+05          -3.060481D-05
                  1.349768D+05          -1.609626D-04
                  3.823067D+04          -6.792348D-04
                  1.247154D+04          -2.466182D-03
                  4.501743D+03          -7.957629D-03
                  1.755212D+03          -2.307248D-02
                  7.273039D+02          -5.932956D-02
                  3.163678D+02          -1.299451D-01
                  1.430098D+02          -2.212352D-01
                  6.621805D+01          -2.292550D-01
                  2.991896D+01           3.580733D-02
                  1.430318D+01           5.107602D-01
                  6.839451D+00           5.008307D-01
                  3.012374D+00           9.011830D-02
                  1.418808D+00          -6.909909D-03
                  6.236240D-01          -1.912925D-04
                  1.340980D-01          -6.032312D-04
                  6.554800D-02           5.621608D-04
                  2.958400D-02          -1.021109D-04
            S    20   1.00
                  3.960805D+06           9.462709D-07
                  5.931155D+05           7.360584D-06
                  1.349768D+05           3.869935D-05
                  3.823067D+04           1.635110D-04
                  1.247154D+04           5.941775D-04
                  4.501743D+03           1.927737D-03
                  1.755212D+03           5.641731D-03
                  7.273039D+02           1.487848D-02
                  3.163678D+02           3.414783D-02
                  1.430098D+02           6.405794D-02
                  6.621805D+01           7.557659D-02
                  2.991896D+01          -1.946070D-02
                  1.430318D+01          -2.957874D-01
                  6.839451D+00          -4.521170D-01
                  3.012374D+00           1.224531D-01
                  1.418808D+00           7.169756D-01
                  6.236240D-01           4.092712D-01
                  1.340980D-01           2.221969D-02
                  6.554800D-02          -9.011202D-03
                  2.958400D-02           3.691727D-03
            S    20   1.00
                  3.960805D+06          -2.095391D-07
                  5.931155D+05          -1.629439D-06
                  1.349768D+05          -8.570592D-06
                  3.823067D+04          -3.619272D-05
                  1.247154D+04          -1.316146D-04
                  4.501743D+03          -4.266810D-04
                  1.755212D+03          -1.250270D-03
                  7.273039D+02          -3.294665D-03
                  3.163678D+02          -7.581860D-03
                  1.430098D+02          -1.422864D-02
                  6.621805D+01          -1.693796D-02
                  2.991896D+01           4.454298D-03
                  1.430318D+01           6.867042D-02
                  6.839451D+00           1.113335D-01
                  3.012374D+00          -3.900820D-02
                  1.418808D+00          -2.215755D-01
                  6.236240D-01          -2.544359D-01
                  1.340980D-01           2.865866D-01
                  6.554800D-02           5.755741D-01
                  2.958400D-02           2.898778D-01
            S    20   1.00
                  3.960805D+06          -4.121231D-07
                  5.931155D+05          -3.282099D-06
                  1.349768D+05          -1.667433D-05
                  3.823067D+04          -7.369999D-05
                  1.247154D+04          -2.529495D-04
                  4.501743D+03          -8.801425D-04
                  1.755212D+03          -2.365482D-03
                  7.273039D+02          -6.926354D-03
                  3.163678D+02          -1.393851D-02
                  1.430098D+02          -3.143840D-02
                  6.621805D+01          -2.625749D-02
                  2.991896D+01          -1.048313D-02
                  1.430318D+01           1.856472D-01
                  6.839451D+00           1.524839D-01
                  3.012374D+00           7.411368D-02
                  1.418808D+00          -1.018097D+00
                  6.236240D-01           2.980372D-01
                  1.340980D-01           1.971989D+00
                  6.554800D-02          -1.179253D+00
                  2.958400D-02          -5.837703D-01
            S    1   1.00
                  2.958400D-02           1.000000D+00
            S    1   1.00
                  1.335000D-02           1.000000D+00
            P    16   1.00
                  1.620586D+04           4.200000D-05
                  3.836274D+03           3.730000D-04
                  1.246048D+03           2.149000D-03
                  4.767535D+02           9.445000D-03
                  2.021895D+02           3.329700D-02
                  9.209487D+01           9.475900D-02
                  4.414720D+01           2.081440D-01
                  2.185468D+01           3.318050D-01
                  1.108596D+01           3.331750D-01
                  5.674108D+00           1.576010D-01
                  2.823170D+00           2.144500D-02
                  1.368621D+00          -2.558000D-03
                  6.444310D-01          -2.027000D-03
                  2.483820D-01          -3.600000D-04
                  9.725500D-02           3.400000D-05
                  3.663300D-02          -1.300000D-05
            P    16   1.00
                  1.620586D+04          -1.500000D-05
                  3.836274D+03          -1.290000D-04
                  1.246048D+03          -7.480000D-04
                  4.767535D+02          -3.308000D-03
                  2.021895D+02          -1.181100D-02
                  9.209487D+01          -3.453300D-02
                  4.414720D+01          -7.878500D-02
                  2.185468D+01          -1.321830D-01
                  1.108596D+01          -1.371950D-01
                  5.674108D+00           2.707500D-02
                  2.823170D+00           3.288910D-01
                  1.368621D+00           4.572800D-01
                  6.444310D-01           2.889080D-01
                  2.483820D-01           4.743300D-02
                  9.725500D-02          -3.522000D-03
                  3.663300D-02           1.456000D-03
            P    16   1.00
                  1.620586D+04           3.000000D-06
                  3.836274D+03           3.000000D-05
                  1.246048D+03           1.720000D-04
                  4.767535D+02           7.620000D-04
                  2.021895D+02           2.726000D-03
                  9.209487D+01           7.976000D-03
                  4.414720D+01           1.828700D-02
                  2.185468D+01           3.077600D-02
                  1.108596D+01           3.237300D-02
                  5.674108D+00          -9.978000D-03
                  2.823170D+00          -9.052900D-02
                  1.368621D+00          -1.380040D-01
                  6.444310D-01          -7.796500D-02
                  2.483820D-01           2.295600D-01
                  9.725500D-02           5.761220D-01
                  3.663300D-02           3.485380D-01
            P    16   1.00
                  1.620586D+04           4.000000D-06
                  3.836274D+03           4.000000D-05
                  1.246048D+03           2.260000D-04
                  4.767535D+02           1.013000D-03
                  2.021895D+02           3.575000D-03
                  9.209487D+01           1.061200D-02
                  4.414720D+01           2.390200D-02
                  2.185468D+01           4.127900D-02
                  1.108596D+01           4.147500D-02
                  5.674108D+00          -9.458000D-03
                  2.823170D+00          -1.236950D-01
                  1.368621D+00          -1.743920D-01
                  6.444310D-01          -1.291700D-01
                  2.483820D-01           4.003480D-01
                  9.725500D-02           6.696460D-01
                  3.663300D-02           8.273200D-02
            P    1   1.00
                  3.663300D-02           1.000000D+00
            P    1   1.00
                  1.380000D-02           1.000000D+00
            D    8   1.00
                  1.006630D+02           3.579000D-03
                  2.983360D+01           2.582700D-02
                  1.088940D+01           9.855900D-02
                  4.393580D+00           2.383270D-01
                  1.817820D+00           3.587070D-01
                  7.278270D-01           3.650920D-01
                  2.712950D-01           2.337380D-01
                  8.830900D-02           5.661800D-02
            D    8   1.00
                  1.006630D+02          -3.454000D-03
                  2.983360D+01          -2.492500D-02
                  1.088940D+01          -9.763500D-02
                  4.393580D+00          -2.366920D-01
                  1.817820D+00          -2.923500D-01
                  7.278270D-01          -4.973000D-03
                  2.712950D-01           5.065880D-01
                  8.830900D-02           4.979510D-01
            D    1   1.00
                  8.830900D-02           1.000000D+00
            D    1   1.00
                  2.875000D-02           1.000000D+00
            F    2   1.00
                  2.703200D+00           4.267760D-01
                  6.438000D-01           7.697990D-01
            F    1   1.00
                  2.226000D-01           1.000000D+00
            ****
            -Fe     0
            S    20   1.00
                  4.316265D+06           8.048803D-06
                  6.463424D+05           6.258306D-05
                  1.470897D+05           3.290239D-04
                  4.166152D+04           1.387355D-03
                  1.359077D+04           5.023256D-03
                  4.905750D+03           1.610140D-02
                  1.912746D+03           4.590034D-02
                  7.926043D+02           1.136154D-01
                  3.448065D+02           2.283869D-01
                  1.558999D+02           3.221159D-01
                  7.223091D+01           2.383661D-01
                  3.272506D+01           7.404667D-02
                  1.566762D+01           9.214197D-02
                  7.503483D+00           9.339790D-02
                  3.312223D+00           1.573965D-02
                  1.558471D+00          -4.186682D-04
                  6.839140D-01           5.376318D-05
                  1.467570D-01          -3.816654D-05
                  7.058300D-02           4.319603D-05
                  3.144900D-02          -3.401019D-06
            S    20   1.00
                  4.316265D+06          -4.155954D-06
                  6.463424D+05          -3.231401D-05
                  1.470897D+05          -1.699525D-04
                  4.166152D+04          -7.171369D-04
                  1.359077D+04          -2.603625D-03
                  4.905750D+03          -8.399109D-03
                  1.912746D+03          -2.434109D-02
                  7.926043D+02          -6.251948D-02
                  3.448065D+02          -1.365929D-01
                  1.558999D+02          -2.312707D-01
                  7.223091D+01          -2.383734D-01
                  3.272506D+01           3.123837D-02
                  1.566762D+01           5.086818D-01
                  7.503483D+00           4.987695D-01
                  3.312223D+00           9.033552D-02
                  1.558471D+00          -6.005337D-03
                  6.839140D-01           2.312454D-04
                  1.467570D-01          -5.643680D-04
                  7.058300D-02           4.992260D-04
                  3.144900D-02          -1.015293D-04
            S    20   1.00
                  4.316265D+06           9.532178D-07
                  6.463424D+05           7.414605D-06
                  1.470897D+05           3.898393D-05
                  4.166152D+04           1.647152D-04
                  1.359077D+04           5.985980D-04
                  4.905750D+03           1.942390D-03
                  1.912746D+03           5.687237D-03
                  7.926043D+02           1.501329D-02
                  3.448065D+02           3.452455D-02
                  1.558999D+02           6.495820D-02
                  7.223091D+01           7.716194D-02
                  3.272506D+01          -1.873411D-02
                  1.566762D+01          -3.009185D-01
                  7.503483D+00          -4.554661D-01
                  3.312223D+00           1.286463D-01
                  1.558471D+00           7.183316D-01
                  6.839140D-01           4.051743D-01
                  1.467570D-01           2.168227D-02
                  7.058300D-02          -8.343566D-03
                  3.144900D-02           3.658979D-03
            S    20   1.00
                  4.316265D+06          -2.063008D-07
                  6.463424D+05          -1.604169D-06
                  1.470897D+05          -8.438437D-06
                  4.166152D+04          -3.563151D-05
                  1.359077D+04          -1.295998D-04
                  4.905750D+03          -4.201534D-04
                  1.912746D+03          -1.231954D-03
                  7.926043D+02          -3.248922D-03
                  3.448065D+02          -7.493717D-03
                  1.558999D+02          -1.410102D-02
                  7.223091D+01          -1.691600D-02
                  3.272506D+01           4.218996D-03
                  1.566762D+01           6.833810D-02
                  7.503483D+00           1.098201D-01
                  3.312223D+00          -4.009005D-02
                  1.558471D+00          -2.174739D-01
                  6.839140D-01          -2.465135D-01
                  1.467570D-01           2.731435D-01
                  7.058300D-02           5.748321D-01
                  3.144900D-02           3.012713D-01
            S    20   1.00
                  4.316265D+06          -4.009367D-07
                  6.463424D+05          -3.189255D-06
                  1.470897D+05          -1.623079D-05
                  4.166152D+04          -7.157920D-05
                  1.359077D+04          -2.463958D-04
                  4.905750D+03          -8.544907D-04
                  1.912746D+03          -2.307593D-03
                  7.926043D+02          -6.728292D-03
                  3.448065D+02          -1.366165D-02
                  1.558999D+02          -3.062240D-02
                  7.223091D+01          -2.631137D-02
                  3.272506D+01          -9.760183D-03
                  1.566762D+01           1.801906D-01
                  7.503483D+00           1.529634D-01
                  3.312223D+00           5.505413D-02
                  1.558471D+00          -9.551364D-01
                  6.839140D-01           2.586813D-01
                  1.467570D-01           1.834049D+00
                  7.058300D-02          -9.333240D-01
                  3.144900D-02          -6.981605D-01
            S    1   1.00
                  3.144900D-02           1.000000D+00
            S    1   1.00
                  1.401000D-02           1.000000D+00
            P    16   1.00
                  1.774569D+04           4.100000D-05
                  4.200721D+03           3.690000D-04
                  1.364429D+03           2.129000D-03
                  5.220806D+02           9.369000D-03
                  2.214595D+02           3.309700D-02
                  1.009096D+02           9.443100D-02
                  4.840115D+01           2.080770D-01
                  2.398536D+01           3.323330D-01
                  1.218250D+01           3.329870D-01
                  6.242298D+00           1.568430D-01
                  3.110944D+00           2.154900D-02
                  1.509958D+00          -2.095000D-03
                  7.108450D-01          -1.739000D-03
                  2.731900D-01          -3.000000D-04
                  1.042330D-01           2.900000D-05
                  3.829100D-02          -1.100000D-05
            P    16   1.00
                  1.774569D+04          -1.500000D-05
                  4.200721D+03          -1.300000D-04
                  1.364429D+03          -7.510000D-04
                  5.220806D+02          -3.329000D-03
                  2.214595D+02          -1.191200D-02
                  1.009096D+02          -3.493300D-02
                  4.840115D+01          -7.998900D-02
                  2.398536D+01          -1.346360D-01
                  1.218250D+01          -1.385980D-01
                  6.242298D+00           3.027800D-02
                  3.110944D+00           3.332160D-01
                  1.509958D+00           4.561530D-01
                  7.108450D-01           2.850510D-01
                  2.731900D-01           4.614400D-02
                  1.042330D-01          -3.249000D-03
                  3.829100D-02           1.357000D-03
            P    16   1.00
                  1.774569D+04           3.000000D-06
                  4.200721D+03           2.900000D-05
                  1.364429D+03           1.650000D-04
                  5.220806D+02           7.340000D-04
                  2.214595D+02           2.626000D-03
                  1.009096D+02           7.725000D-03
                  4.840115D+01           1.773300D-02
                  2.398536D+01           3.005500D-02
                  1.218250D+01           3.109400D-02
                  6.242298D+00          -1.004800D-02
                  3.110944D+00          -8.830600D-02
                  1.509958D+00          -1.298240D-01
                  7.108450D-01          -7.693700D-02
                  2.731900D-01           2.126610D-01
                  1.042330D-01           5.730610D-01
                  3.829100D-02           3.696510D-01
            P    16   1.00
                  1.774569D+04           5.000000D-06
                  4.200721D+03           4.200000D-05
                  1.364429D+03           2.410000D-04
                  5.220806D+02           1.085000D-03
                  2.214595D+02           3.831000D-03
                  1.009096D+02           1.142300D-02
                  4.840115D+01           2.579200D-02
                  2.398536D+01           4.481800D-02
                  1.218250D+01           4.459800D-02
                  6.242298D+00          -1.117700D-02
                  3.110944D+00          -1.381340D-01
                  1.509958D+00          -1.882850D-01
                  7.108450D-01          -1.073990D-01
                  2.731900D-01           4.448630D-01
                  1.042330D-01           6.402390D-01
                  3.829100D-02           6.445700D-02
            P    1   1.00
                  3.829100D-02           1.000000D+00
            P    1   1.00
                  1.407000D-02           1.000000D+00
            D    8   1.00
                  1.133440D+02           3.530000D-03
                  3.364140D+01           2.578400D-02
                  1.233100D+01           9.911900D-02
                  4.994780D+00           2.390730D-01
                  2.072800D+00           3.571990D-01
                  8.307530D-01           3.621880D-01
                  3.091780D-01           2.364610D-01
                  1.001300D-01           6.011800D-02
            D    8   1.00
                  1.133440D+02          -3.890000D-03
                  3.364140D+01          -2.844200D-02
                  1.233100D+01          -1.124290D-01
                  4.994780D+00          -2.742570D-01
                  2.072800D+00          -3.155460D-01
                  8.307530D-01           5.710900D-02
                  3.091780D-01           5.636040D-01
                  1.001300D-01           3.846370D-01
            D    1   1.00
                  1.001300D-01           1.000000D+00
            D    1   1.00
                  3.243000D-02           1.000000D+00
            F    2   1.00
                  3.224300D+00           4.222490D-01
                  7.758000D-01           7.714680D-01
            F    1   1.00
                  2.749000D-01           1.000000D+00
            ****
            -Co     0
            S    20   1.00
                  4.675675D+06           7.979026D-06
                  7.001615D+05           6.204071D-05
                  1.593373D+05           3.261735D-04
                  4.513046D+04           1.375360D-03
                  1.472238D+04           4.979997D-03
                  5.314222D+03           1.596434D-02
                  2.072018D+03           4.552086D-02
                  8.586188D+02           1.127385D-01
                  3.735497D+02           2.268262D-01
                  1.689229D+02           3.203074D-01
                  7.829639D+01           2.374021D-01
                  3.552123D+01           7.477686D-02
                  1.704144D+01           9.581872D-02
                  8.173000D+00           9.649911D-02
                  3.610318D+00           1.623362D-02
                  1.697047D+00          -4.535497D-04
                  7.435320D-01           5.113519D-05
                  1.583440D-01          -4.174508D-05
                  7.503600D-02           4.027577D-05
                  3.309100D-02          -5.789067D-06
            S    20   1.00
                  4.675675D+06          -4.200240D-06
                  7.001615D+05          -3.265831D-05
                  1.593373D+05          -1.717644D-04
                  4.513046D+04          -7.247853D-04
                  1.472238D+04          -2.631462D-03
                  5.314222D+03          -8.489272D-03
                  2.072018D+03          -2.460619D-02
                  8.586188D+02          -6.322059D-02
                  3.735497D+02          -1.381957D-01
                  1.689229D+02          -2.340680D-01
                  7.829639D+01          -2.415002D-01
                  3.552123D+01           3.035312D-02
                  1.704144D+01           5.101341D-01
                  8.173000D+00           4.974939D-01
                  3.610318D+00           8.970746D-02
                  1.697047D+00          -5.941034D-03
                  7.435320D-01           2.175362D-04
                  1.583440D-01          -5.480155D-04
                  7.503600D-02           4.525804D-04
                  3.309100D-02          -1.066748D-04
            S    20   1.00
                  4.675675D+06           9.592692D-07
                  7.001615D+05           7.461851D-06
                  1.593373D+05           3.923137D-05
                  4.513046D+04           1.657706D-04
                  1.472238D+04           6.024335D-04
                  5.314222D+03           1.955217D-03
                  2.072018D+03           5.726326D-03
                  8.586188D+02           1.512984D-02
                  3.735497D+02           3.483973D-02
                  1.689229D+02           6.570351D-02
                  7.829639D+01           7.831503D-02
                  3.552123D+01          -1.877037D-02
                  1.704144D+01          -3.062663D-01
                  8.173000D+00          -4.566429D-01
                  3.610318D+00           1.378169D-01
                  1.697047D+00           7.193676D-01
                  7.435320D-01           3.992579D-01
                  1.583440D-01           2.079933D-02
                  7.503600D-02          -7.820663D-03
                  3.309100D-02           3.533911D-03
            S    20   1.00
                  4.675675D+06          -2.028840D-07
                  7.001615D+05          -1.577580D-06
                  1.593373D+05          -8.298813D-06
                  4.513046D+04          -3.504154D-05
                  1.472238D+04          -1.274655D-04
                  5.314222D+03          -4.132695D-04
                  2.072018D+03          -1.212261D-03
                  8.586188D+02          -3.199318D-03
                  3.735497D+02          -7.390972D-03
                  1.689229D+02          -1.393649D-02
                  7.829639D+01          -1.678575D-02
                  3.552123D+01           4.149856D-03
                  1.704144D+01           6.797646D-02
                  8.173000D+00           1.075807D-01
                  3.610318D+00          -4.166022D-02
                  1.697047D+00          -2.128044D-01
                  7.435320D-01          -2.381360D-01
                  1.583440D-01           2.650788D-01
                  7.503600D-02           5.722774D-01
                  3.309100D-02           3.091556D-01
            S    20   1.00
                  4.675675D+06          -3.863053D-07
                  7.001615D+05          -3.068788D-06
                  1.593373D+05          -1.564826D-05
                  4.513046D+04          -6.883588D-05
                  1.472238D+04          -2.377367D-04
                  5.314222D+03          -8.213173D-04
                  2.072018D+03          -2.229630D-03
                  8.586188D+02          -6.467841D-03
                  3.735497D+02          -1.325463D-02
                  1.689229D+02          -2.946686D-02
                  7.829639D+01          -2.599066D-02
                  3.552123D+01          -8.499807D-03
                  1.704144D+01           1.727316D-01
                  8.173000D+00           1.512189D-01
                  3.610318D+00           3.554509D-02
                  1.697047D+00          -8.829353D-01
                  7.435320D-01           2.143530D-01
                  1.583440D-01           1.711865D+00
                  7.503600D-02          -7.140037D-01
                  3.309100D-02          -8.027727D-01
            S    1   1.00
                  3.309100D-02           1.000000D+00
            S    1   1.00
                  1.459000D-02           1.000000D+00
            P    16   1.00
                  1.926778D+04           4.100000D-05
                  4.560986D+03           3.690000D-04
                  1.481436D+03           2.128000D-03
                  5.668671D+02           9.372000D-03
                  2.404910D+02           3.315500D-02
                  1.096105D+02           9.475200D-02
                  5.259491D+01           2.090930D-01
                  2.608361D+01           3.337220D-01
                  1.326143D+01           3.322080D-01
                  6.799778D+00           1.546130D-01
                  3.393414D+00           2.090200D-02
                  1.648766D+00          -2.024000D-03
                  7.762820D-01          -1.697000D-03
                  2.980030D-01          -2.800000D-04
                  1.136180D-01           2.600000D-05
                  4.162400D-02          -1.000000D-05
            P    16   1.00
                  1.926778D+04          -1.500000D-05
                  4.560986D+03          -1.310000D-04
                  1.481436D+03          -7.580000D-04
                  5.668671D+02          -3.363000D-03
                  2.404910D+02          -1.205400D-02
                  1.096105D+02          -3.542400D-02
                  5.259491D+01          -8.128700D-02
                  2.608361D+01          -1.369080D-01
                  1.326143D+01          -1.390190D-01
                  6.799778D+00           3.546800D-02
                  3.393414D+00           3.384980D-01
                  1.648766D+00           4.544330D-01
                  7.762820D-01           2.797930D-01
                  2.980030D-01           4.477600D-02
                  1.136180D-01          -3.151000D-03
                  4.162400D-02           1.317000D-03
            P    16   1.00
                  1.926778D+04          -3.000000D-06
                  4.560986D+03          -2.900000D-05
                  1.481436D+03          -1.670000D-04
                  5.668671D+02          -7.420000D-04
                  2.404910D+02          -2.662000D-03
                  1.096105D+02          -7.841000D-03
                  5.259491D+01          -1.805100D-02
                  2.608361D+01          -3.058000D-02
                  1.326143D+01          -3.131200D-02
                  6.799778D+00           1.131100D-02
                  3.393414D+00           8.999000D-02
                  1.648766D+00           1.307330D-01
                  7.762820D-01           7.180800D-02
                  2.980030D-01          -2.216580D-01
                  1.136180D-01          -5.710250D-01
                  4.162400D-02          -3.637890D-01
            P    16   1.00
                  1.926778D+04           5.000000D-06
                  4.560986D+03           4.500000D-05
                  1.481436D+03           2.550000D-04
                  5.668671D+02           1.144000D-03
                  2.404910D+02           4.061000D-03
                  1.096105D+02           1.209500D-02
                  5.259491D+01           2.747600D-02
                  2.608361D+01           4.755700D-02
                  1.326143D+01           4.730200D-02
                  6.799778D+00          -1.441800D-02
                  3.393414D+00          -1.500620D-01
                  1.648766D+00          -1.990920D-01
                  7.762820D-01          -7.978300D-02
                  2.980030D-01           4.590350D-01
                  1.136180D-01           6.174950D-01
                  4.162400D-02           6.469000D-02
            P    1   1.00
                  4.162400D-02           1.000000D+00
            P    1   1.00
                  1.525000D-02           1.000000D+00
            D    8   1.00
                  1.262640D+02           3.510000D-03
                  3.752260D+01           2.588400D-02
                  1.380210D+01           1.000580D-01
                  5.609270D+00           2.405470D-01
                  2.333690D+00           3.568430D-01
                  9.364150D-01           3.595790D-01
                  3.482370D-01           2.366290D-01
                  1.123530D-01           6.212900D-02
            D    8   1.00
                  1.262640D+02          -4.067000D-03
                  3.752260D+01          -3.005300D-02
                  1.380210D+01          -1.196200D-01
                  5.609270D+00          -2.915130D-01
                  2.333690D+00          -3.180480D-01
                  9.364150D-01           9.169800D-02
                  3.482370D-01           5.608230D-01
                  1.123530D-01           3.586780D-01
            D    1   1.00
                  1.123530D-01           1.000000D+00
            D    1   1.00
                  3.625000D-02           1.000000D+00
            F    2   1.00
                  3.772400D+00           4.239660D-01
                  9.170000D-01           7.684290D-01
            F    1   1.00
                  3.271500D-01           1.000000D+00
            ****
            -Ni     0
            S    20   1.00
                  5.045991D+06           8.208996D-06
                  7.556142D+05           6.382884D-05
                  1.719568D+05           3.355800D-04
                  4.870479D+04           1.415075D-03
                  1.588841D+04           5.124444D-03
                  5.735123D+03           1.643256D-02
                  2.236137D+03           4.689398D-02
                  9.266468D+02           1.163534D-01
                  4.031743D+02           2.350511D-01
                  1.823476D+02           3.350184D-01
                  8.454885D+01           2.534779D-01
                  3.839634D+01           7.300901D-02
                  1.845859D+01           6.184244D-02
                  8.863548D+00           6.302956D-02
                  3.916227D+00           1.008063D-02
                  1.838870D+00          -2.244528D-04
                  8.043620D-01          -5.932767D-05
                  1.697970D-01          -1.158562D-05
                  7.930600D-02           8.115109D-06
                  3.467700D-02          -1.681699D-06
            S    20   1.00
                  5.045991D+06          -3.657849D-06
                  7.556142D+05          -2.844094D-05
                  1.719568D+05          -1.495928D-04
                  4.870479D+04          -6.313009D-04
                  1.588841D+04          -2.293052D-03
                  5.735123D+03          -7.405123D-03
                  2.236137D+03          -2.152032D-02
                  9.266468D+02          -5.560974D-02
                  4.031743D+02          -1.230176D-01
                  1.823476D+02          -2.130104D-01
                  8.454885D+01          -2.265837D-01
                  3.839634D+01           3.546796D-02
                  1.845859D+01           5.181697D-01
                  8.863548D+00           5.025630D-01
                  3.916227D+00           8.955674D-02
                  1.838870D+00          -7.031311D-03
                  8.043620D-01          -4.339167D-04
                  1.697970D-01          -5.831711D-04
                  7.930600D-02           4.228788D-04
                  3.467700D-02          -1.266714D-04
            S    20   1.00
                  5.045991D+06           9.594149D-07
                  7.556142D+05           7.462614D-06
                  1.719568D+05           3.923843D-05
                  4.870479D+04           1.657868D-04
                  1.588841D+04           6.025905D-04
                  5.735123D+03           1.955662D-03
                  2.236137D+03           5.730391D-03
                  9.266468D+02           1.514756D-02
                  4.031743D+02           3.493499D-02
                  1.823476D+02           6.598072D-02
                  8.454885D+01           7.893083D-02
                  3.839634D+01          -1.906249D-02
                  1.845859D+01          -3.095921D-01
                  8.863548D+00          -4.558610D-01
                  3.916227D+00           1.482931D-01
                  1.838870D+00           7.134039D-01
                  8.043620D-01           3.976063D-01
                  1.697970D-01           2.295523D-02
                  7.930600D-02          -9.151758D-03
                  3.467700D-02           3.875414D-03
            S    20   1.00
                  5.045991D+06          -2.013753D-07
                  7.556142D+05          -1.565832D-06
                  1.719568D+05          -8.237182D-06
                  4.870479D+04          -3.478105D-05
                  1.588841D+04          -1.265265D-04
                  5.735123D+03          -4.102589D-04
                  2.236137D+03          -1.203834D-03
                  9.266468D+02          -3.179062D-03
                  4.031743D+02          -7.353828D-03
                  1.823476D+02          -1.389022D-02
                  8.454885D+01          -1.677875D-02
                  3.839634D+01           4.163378D-03
                  1.845859D+01           6.814703D-02
                  8.863548D+00           1.061029D-01
                  3.916227D+00          -4.339980D-02
                  1.838870D+00          -2.094950D-01
                  8.043620D-01          -2.310271D-01
                  1.697970D-01           2.590532D-01
                  7.930600D-02           5.691426D-01
                  3.467700D-02           3.158125D-01
            S    20   1.00
                  5.045991D+06          -3.924245D-07
                  7.556142D+05          -3.113909D-06
                  1.719568D+05          -1.590447D-05
                  4.870479D+04          -6.981394D-05
                  1.588841D+04          -2.417848D-04
                  5.735123D+03          -8.326195D-04
                  2.236137D+03          -2.270294D-03
                  9.266468D+02          -6.557427D-03
                  4.031743D+02          -1.354288D-02
                  1.823476D+02          -2.989768D-02
                  8.454885D+01          -2.693106D-02
                  3.839634D+01          -7.827693D-03
                  1.845859D+01           1.741667D-01
                  8.863548D+00           1.595468D-01
                  3.916227D+00           1.995550D-02
                  1.838870D+00          -8.897000D-01
                  8.043620D-01           2.486892D-01
                  1.697970D-01           1.613012D+00
                  7.930600D-02          -5.990277D-01
                  3.467700D-02          -8.369078D-01
            S    1   1.00
                  3.467700D-02           1.000000D+00
            S    1   1.00
                  1.516000D-02           1.000000D+00
            P    16   1.00
                  2.102792D+04           4.100000D-05
                  4.977560D+03           3.630000D-04
                  1.616740D+03           2.097000D-03
                  6.186718D+02           9.250000D-03
                  2.625183D+02           3.279600D-02
                  1.196907D+02           9.400400D-02
                  5.746585D+01           2.082800D-01
                  2.852829D+01           3.336540D-01
                  1.452148D+01           3.329040D-01
                  7.453850D+00           1.553720D-01
                  3.723553D+00           2.085900D-02
                  1.809813D+00          -2.440000D-03
                  8.513360D-01          -1.998000D-03
                  3.248140D-01          -3.380000D-04
                  1.195220D-01           3.500000D-05
                  4.236600D-02          -1.200000D-05
            P    16   1.00
                  2.102792D+04          -1.500000D-05
                  4.977560D+03          -1.290000D-04
                  1.616740D+03          -7.490000D-04
                  6.186718D+02          -3.328000D-03
                  2.625183D+02          -1.194700D-02
                  1.196907D+02          -3.524200D-02
                  5.746585D+01          -8.120400D-02
                  2.852829D+01          -1.374930D-01
                  1.452148D+01          -1.392260D-01
                  7.453850D+00           3.601600D-02
                  3.723553D+00           3.391280D-01
                  1.809813D+00           4.504720D-01
                  8.513360D-01           2.817830D-01
                  3.248140D-01           4.789800D-02
                  1.195220D-01          -2.987000D-03
                  4.236600D-02           1.309000D-03
            P    16   1.00
                  2.102792D+04           3.000000D-06
                  4.977560D+03           2.600000D-05
                  1.616740D+03           1.520000D-04
                  6.186718D+02           6.780000D-04
                  2.625183D+02           2.427000D-03
                  1.196907D+02           7.201000D-03
                  5.746585D+01           1.657800D-02
                  2.852829D+01           2.839200D-02
                  1.452148D+01           2.859900D-02
                  7.453850D+00          -1.013200D-02
                  3.723553D+00          -8.291200D-02
                  1.809813D+00          -1.159980D-01
                  8.513360D-01          -7.279500D-02
                  3.248140D-01           1.956400D-01
                  1.195220D-01           5.670990D-01
                  4.236600D-02           3.952700D-01
            P    16   1.00
                  2.102792D+04           6.000000D-06
                  4.977560D+03           5.300000D-05
                  1.616740D+03           3.050000D-04
                  6.186718D+02           1.364000D-03
                  2.625183D+02           4.876000D-03
                  1.196907D+02           1.450300D-02
                  5.746585D+01           3.329600D-02
                  2.852829D+01           5.748200D-02
                  1.452148D+01           5.870200D-02
                  7.453850D+00          -1.990400D-02
                  3.723553D+00          -1.946950D-01
                  1.809813D+00          -2.396130D-01
                  8.513360D-01          -2.232000D-03
                  3.248140D-01           5.214350D-01
                  1.195220D-01           5.455400D-01
                  4.236600D-02           4.362200D-02
            P    1   1.00
                  4.236600D-02           1.000000D+00
            P    1   1.00
                  1.502000D-02           1.000000D+00
            D    8   1.00
                  1.402527D+02           3.376000D-03
                  4.172610D+01           2.514100D-02
                  1.539810D+01           9.774600D-02
                  6.277100D+00           2.347090D-01
                  2.618500D+00           3.469450D-01
                  1.052600D+00           3.510680D-01
                  3.916000D-01           2.502550D-01
                  1.262000D-01           1.000820D-01
            D    8   1.00
                  1.402527D+02          -3.495000D-03
                  4.172610D+01          -2.601500D-02
                  1.539810D+01          -1.038760D-01
                  6.277100D+00          -2.520700D-01
                  2.618500D+00          -2.945800D-01
                  1.052600D+00           1.152000D-03
                  3.916000D-01           4.385890D-01
                  1.262000D-01           5.436260D-01
            D    1   1.00
                  1.262000D-01           1.000000D+00
            D    1   1.00
                  4.067000D-02           1.000000D+00
            F    2   1.00
                  4.345500D+00           4.174290D-01
                  1.068000D+00           7.714830D-01
            F    1   1.00
                  4.083000D-01           1.000000D+00
            ****
            -Cu     0
            S    20   1.00
                  5.430321D+06           7.801026D-06
                  8.131665D+05           6.065666D-05
                  1.850544D+05           3.188964D-04
                  5.241466D+04           1.344687D-03
                  1.709868D+04           4.869050D-03
                  6.171994D+03           1.561013D-02
                  2.406481D+03           4.452077D-02
                  9.972584D+02           1.103111D-01
                  4.339289D+02           2.220342D-01
                  1.962869D+02           3.133739D-01
                  9.104280D+01           2.315121D-01
                  4.138425D+01           7.640920D-02
                  1.993278D+01           1.103818D-01
                  9.581891D+00           1.094372D-01
                  4.234516D+00           1.836311D-02
                  1.985814D+00          -6.043084D-04
                  8.670830D-01           5.092245D-05
                  1.813390D-01          -5.540730D-05
                  8.365700D-02           3.969482D-05
                  3.626700D-02          -1.269538D-05
            S    20   1.00
                  5.430321D+06          -4.404706D-06
                  8.131665D+05          -3.424801D-05
                  1.850544D+05          -1.801238D-04
                  5.241466D+04          -7.600455D-04
                  1.709868D+04          -2.759348D-03
                  6.171994D+03          -8.900970D-03
                  2.406481D+03          -2.579378D-02
                  9.972584D+02          -6.623861D-02
                  4.339289D+02          -1.445927D-01
                  1.962869D+02          -2.440110D-01
                  9.104280D+01          -2.504837D-01
                  4.138425D+01           2.852577D-02
                  1.993278D+01           5.115874D-01
                  9.581891D+00           4.928061D-01
                  4.234516D+00           8.788437D-02
                  1.985814D+00          -5.820281D-03
                  8.670830D-01           2.013508D-04
                  1.813390D-01          -5.182553D-04
                  8.365700D-02           3.731503D-04
                  3.626700D-02          -1.193171D-04
            S    20   1.00
                  5.430321D+06           9.704682D-07
                  8.131665D+05           7.549245D-06
                  1.850544D+05           3.968892D-05
                  5.241466D+04           1.677200D-04
                  1.709868D+04           6.095101D-04
                  6.171994D+03           1.978846D-03
                  2.406481D+03           5.798049D-03
                  9.972584D+02           1.534158D-02
                  4.339289D+02           3.540484D-02
                  1.962869D+02           6.702098D-02
                  9.104280D+01           8.026945D-02
                  4.138425D+01          -1.927231D-02
                  1.993278D+01          -3.160129D-01
                  9.581891D+00          -4.573162D-01
                  4.234516D+00           1.550841D-01
                  1.985814D+00           7.202872D-01
                  8.670830D-01           3.885122D-01
                  1.813390D-01           1.924326D-02
                  8.365700D-02          -7.103807D-03
                  3.626700D-02           3.272906D-03
            S    20   1.00
                  5.430321D+06          -1.959354D-07
                  8.131665D+05          -1.523472D-06
                  1.850544D+05          -8.014808D-06
                  5.241466D+04          -3.383992D-05
                  1.709868D+04          -1.231191D-04
                  6.171994D+03          -3.992085D-04
                  2.406481D+03          -1.171900D-03
                  9.972584D+02          -3.096141D-03
                  4.339289D+02          -7.171993D-03
                  1.962869D+02          -1.356621D-02
                  9.104280D+01          -1.643989D-02
                  4.138425D+01           4.107628D-03
                  1.993278D+01           6.693964D-02
                  9.581891D+00           1.028221D-01
                  4.234516D+00          -4.422945D-02
                  1.985814D+00          -2.031191D-01
                  8.670830D-01          -2.230022D-01
                  1.813390D-01           2.517975D-01
                  8.365700D-02           5.650091D-01
                  3.626700D-02           3.247243D-01
            S    20   1.00
                  5.430321D+06          -3.532229D-07
                  8.131665D+05          -2.798812D-06
                  1.850544D+05          -1.432517D-05
                  5.241466D+04          -6.270946D-05
                  1.709868D+04          -2.179490D-04
                  6.171994D+03          -7.474316D-04
                  2.406481D+03          -2.049271D-03
                  9.972584D+02          -5.885203D-03
                  4.339289D+02          -1.226885D-02
                  1.962869D+02          -2.683147D-02
                  9.104280D+01          -2.479261D-02
                  4.138425D+01          -5.984746D-03
                  1.993278D+01           1.557124D-01
                  9.581891D+00           1.436683D-01
                  4.234516D+00           8.374103D-03
                  1.985814D+00          -7.460711D-01
                  8.670830D-01           1.244367D-01
                  1.813390D-01           1.510110D+00
                  8.365700D-02          -3.477122D-01
                  3.626700D-02          -9.774169D-01
            S    1   1.00
                  3.626700D-02           1.000000D+00
            S    1   1.00
                  1.572000D-02           1.000000D+00
            P    16   1.00
                  2.276057D+04           4.000000D-05
                  5.387679D+03           3.610000D-04
                  1.749945D+03           2.083000D-03
                  6.696653D+02           9.197000D-03
                  2.841948D+02           3.266000D-02
                  1.296077D+02           9.379500D-02
                  6.225415D+01           2.082740D-01
                  3.092964D+01           3.339930D-01
                  1.575827D+01           3.324930D-01
                  8.094211D+00           1.547280D-01
                  4.046921D+00           2.127100D-02
                  1.967869D+00          -1.690000D-03
                  9.252950D-01          -1.516000D-03
                  3.529920D-01          -2.420000D-04
                  1.273070D-01           2.300000D-05
                  4.435600D-02          -9.000000D-06
            P    16   1.00
                  2.276057D+04          -1.500000D-05
                  5.387679D+03          -1.310000D-04
                  1.749945D+03          -7.550000D-04
                  6.696653D+02          -3.359000D-03
                  2.841948D+02          -1.208100D-02
                  1.296077D+02          -3.570300D-02
                  6.225415D+01          -8.250200D-02
                  3.092964D+01          -1.398900D-01
                  1.575827D+01          -1.407290D-01
                  8.094211D+00           3.876600D-02
                  4.046921D+00           3.426950D-01
                  1.967869D+00           4.523100D-01
                  9.252950D-01           2.770540D-01
                  3.529920D-01           4.388500D-02
                  1.273070D-01          -2.802000D-03
                  4.435600D-02           1.152000D-03
            P    16   1.00
                  2.276057D+04           3.000000D-06
                  5.387679D+03           2.500000D-05
                  1.749945D+03           1.470000D-04
                  6.696653D+02           6.560000D-04
                  2.841948D+02           2.351000D-03
                  1.296077D+02           7.004000D-03
                  6.225415D+01           1.613100D-02
                  3.092964D+01           2.777000D-02
                  1.575827D+01           2.756700D-02
                  8.094211D+00          -1.011500D-02
                  4.046921D+00          -8.100900D-02
                  1.967869D+00          -1.104090D-01
                  9.252950D-01          -7.173200D-02
                  3.529920D-01           1.879300D-01
                  1.273070D-01           5.646290D-01
                  4.435600D-02           4.070000D-01
            P    16   1.00
                  2.276057D+04           5.000000D-06
                  5.387679D+03           4.900000D-05
                  1.749945D+03           2.780000D-04
                  6.696653D+02           1.253000D-03
                  2.841948D+02           4.447000D-03
                  1.296077D+02           1.337000D-02
                  6.225415D+01           3.046900D-02
                  3.092964D+01           5.344700D-02
                  1.575827D+01           5.263900D-02
                  8.094211D+00          -1.688100D-02
                  4.046921D+00          -1.794480D-01
                  1.967869D+00          -2.095880D-01
                  9.252950D-01          -3.963300D-02
                  3.529920D-01           5.021300D-01
                  1.273070D-01           5.811110D-01
                  4.435600D-02           4.566600D-02
            P    1   1.00
                  4.435600D-02           1.000000D+00
            P    1   1.00
                  1.545000D-02           1.000000D+00
            D    8   1.00
                  1.738970D+02           2.700000D-03
                  5.188690D+01           2.090900D-02
                  1.934190D+01           8.440800D-02
                  7.975720D+00           2.139990D-01
                  3.398230D+00           3.359800D-01
                  1.409320D+00           3.573010D-01
                  5.488580D-01           2.645780D-01
                  1.901990D-01           1.039720D-01
            D    8   1.00
                  1.738970D+02          -3.363000D-03
                  5.188690D+01          -2.607900D-02
                  1.934190D+01          -1.082310D-01
                  7.975720D+00          -2.822170D-01
                  3.398230D+00          -3.471900D-01
                  1.409320D+00           2.671100D-02
                  5.488580D-01           4.920470D-01
                  1.901990D-01           4.384220D-01
            D    1   1.00
                  1.901990D-01           1.000000D+00
            D    1   1.00
                  6.591000D-02           1.000000D+00
            F    2   1.00
                  5.028600D+00           4.242800D-01
                  1.259400D+00           7.630250D-01
            F    1   1.00
                  4.617200D-01           1.000000D+00
            ****
            -Zn     0
            S    20   1.00
                  5.820021D+06           8.549241D-06
                  8.715234D+05           6.647410D-05
                  1.983350D+05           3.494962D-04
                  5.617631D+04           1.473832D-03
                  1.832582D+04           5.338330D-03
                  6.614955D+03           1.712708D-02
                  2.579199D+03           4.894085D-02
                  1.068849D+03           1.217934D-01
                  4.651045D+02           2.476589D-01
                  2.104130D+02           3.582431D-01
                  9.761629D+01           2.798174D-01
                  4.438020D+01           6.857491D-02
                  2.142308D+01          -1.311092D-03
                  1.030891D+01           1.914001D-03
                  4.553645D+00          -8.759220D-04
                  2.132821D+00           3.740096D-04
                  9.296970D-01          -1.401399D-04
                  1.921470D-01           4.757132D-05
                  8.759500D-02          -3.642711D-05
                  3.770200D-02           1.153248D-05
            S    20   1.00
                  5.820021D+06          -2.640069D-06
                  8.715234D+05          -2.052720D-05
                  1.983350D+05          -1.079859D-04
                  5.617631D+04          -4.558577D-04
                  1.832582D+04          -1.657758D-03
                  6.614955D+03          -5.368492D-03
                  2.579199D+03          -1.571249D-02
                  1.068849D+03          -4.122558D-02
                  4.651045D+02          -9.406459D-02
                  2.104130D+02          -1.719954D-01
                  9.761629D+01          -1.958523D-01
                  4.438020D+01           4.532907D-02
                  2.142308D+01           5.244442D-01
                  1.030891D+01           5.006142D-01
                  4.553645D+00           8.945527D-02
                  2.132821D+00          -2.146262D-03
                  9.296970D-01           2.112113D-03
                  1.921470D-01          -4.133980D-04
                  8.759500D-02           3.209752D-04
                  3.770200D-02          -1.016140D-04
            S    20   1.00
                  5.820021D+06           9.967103D-07
                  8.715234D+05           7.754163D-06
                  1.983350D+05           4.076019D-05
                  5.617631D+04           1.722811D-04
                  1.832582D+04           6.259370D-04
                  6.614955D+03           2.032855D-03
                  2.579199D+03           5.954646D-03
                  1.068849D+03           1.576640D-02
                  4.651045D+02           3.637638D-02
                  2.104130D+02           6.892343D-02
                  9.761629D+01           8.238093D-02
                  4.438020D+01          -2.011360D-02
                  2.142308D+01          -3.252526D-01
                  1.030891D+01          -4.602899D-01
                  4.553645D+00           1.635546D-01
                  2.132821D+00           7.297118D-01
                  9.296970D-01           3.769751D-01
                  1.921470D-01           1.433224D-02
                  8.759500D-02          -6.671210D-03
                  3.770200D-02           1.766214D-03
            S    20   1.00
                  5.820021D+06           1.995818D-07
                  8.715234D+05           1.552973D-06
                  1.983350D+05           8.161259D-06
                  5.617631D+04           3.450747D-05
                  1.832582D+04           1.253275D-04
                  6.614955D+03           4.072990D-04
                  2.579199D+03           1.192734D-03
                  1.068849D+03           3.163140D-03
                  4.651045D+02           7.303942D-03
                  2.104130D+02           1.391279D-02
                  9.761629D+01           1.670620D-02
                  4.438020D+01          -4.035586D-03
                  2.142308D+01          -6.968861D-02
                  1.030891D+01          -1.030105D-01
                  4.553645D+00           4.471442D-02
                  2.132821D+00           2.150027D-01
                  9.296970D-01           2.220163D-01
                  1.921470D-01          -3.114776D-01
                  8.759500D-02          -5.693429D-01
                  3.770200D-02          -2.678440D-01
            S    20   1.00
                  5.820021D+06          -5.435910D-07
                  8.715234D+05          -4.336894D-06
                  1.983350D+05          -2.197572D-05
                  5.617631D+04          -9.747392D-05
                  1.832582D+04          -3.331615D-04
                  6.614955D+03          -1.166192D-03
                  2.579199D+03          -3.119308D-03
                  1.068849D+03          -9.239504D-03
                  4.651045D+02          -1.855471D-02
                  2.104130D+02          -4.281189D-02
                  9.761629D+01          -3.571095D-02
                  4.438020D+01          -1.638350D-02
                  2.142308D+01           2.644664D-01
                  1.030891D+01           2.086588D-01
                  4.553645D+00          -1.774382D-02
                  2.132821D+00          -1.353873D+00
                  9.296970D-01           8.182926D-01
                  1.921470D-01           1.695036D+00
                  8.759500D-02          -1.388656D+00
                  3.770200D-02          -2.188900D-01
            S    1   1.00
                  3.770200D-02           1.000000D+00
            S    1   1.00
                  1.623000D-02           1.000000D+00
            P    16   1.00
                  2.441198D+04          -1.500000D-05
                  5.778518D+03          -1.350000D-04
                  1.876862D+03          -7.820000D-04
                  7.182361D+02          -3.478000D-03
                  3.048327D+02          -1.252000D-02
                  1.390453D+02          -3.701600D-02
                  6.680417D+01          -8.555900D-02
                  3.320699D+01          -1.447180D-01
                  1.692816D+01          -1.434420D-01
                  8.696229D+00           4.359500D-02
                  4.350510D+00           3.488880D-01
                  2.116523D+00           4.538650D-01
                  9.953870D-01           2.685940D-01
                  3.781120D-01           3.886800D-02
                  1.345790D-01          -2.492000D-03
                  4.628200D-02           1.014000D-03
            P    16   1.00
                  2.441198D+04           3.000000D-06
                  5.778518D+03           2.500000D-05
                  1.876862D+03           1.440000D-04
                  7.182361D+02           6.450000D-04
                  3.048327D+02           2.311000D-03
                  1.390453D+02           6.898000D-03
                  6.680417D+01           1.588200D-02
                  3.320699D+01           2.735000D-02
                  1.692816D+01           2.662100D-02
                  8.696229D+00          -1.085800D-02
                  4.350510D+00          -7.985300D-02
                  2.116523D+00          -1.061270D-01
                  9.953870D-01          -6.888300D-02
                  3.781120D-01           1.843850D-01
                  1.345790D-01           5.617880D-01
                  4.628200D-02           4.144160D-01
            P    16   1.00
                  2.441198D+04           5.000000D-06
                  5.778518D+03           4.200000D-05
                  1.876862D+03           2.380000D-04
                  7.182361D+02           1.088000D-03
                  3.048327D+02           3.821000D-03
                  1.390453D+02           1.164400D-02
                  6.680417D+01           2.616700D-02
                  3.320699D+01           4.675000D-02
                  1.692816D+01           4.330900D-02
                  8.696229D+00          -1.342900D-02
                  4.350510D+00          -1.538970D-01
                  2.116523D+00          -1.674130D-01
                  9.953870D-01          -8.499500D-02
                  3.781120D-01           4.508130D-01
                  1.345790D-01           6.408690D-01
                  4.628200D-02           5.417200D-02
            P    15   1.00
                  2.441198D+04           4.100000D-05
                  5.778518D+03           3.610000D-04
                  1.876862D+03           2.088000D-03
                  7.182361D+02           9.221000D-03
                  3.048327D+02           3.277300D-02
                  1.390453D+02           9.417900D-02
                  6.680417D+01           2.091320D-01
                  3.320699D+01           3.345690D-01
                  1.692816D+01           3.303590D-01
                  8.696229D+00           1.523470D-01
                  4.350510D+00           2.298400D-02
                  2.116523D+00           1.607000D-03
                  9.953870D-01           4.680000D-04
                  3.781120D-01           6.600000D-05
                  1.345790D-01          -2.000000D-06
            P    1   1.00
                  4.628200D-02           1.000000D+00
            P    1   1.00
                  1.592000D-02           1.000000D+00
            D    8   1.00
                  2.056177D+02           2.342000D-03
                  6.144981D+01           1.860600D-02
                  2.305689D+01           7.710200D-02
                  9.577739D+00           2.020260D-01
                  4.133734D+00           3.294540D-01
                  1.747518D+00           3.609760D-01
                  6.995600D-01           2.716570D-01
                  2.516080D-01           1.049810D-01
            D    8   1.00
                  2.056177D+02           3.279000D-03
                  6.144981D+01           2.617600D-02
                  2.305689D+01           1.113670D-01
                  9.577739D+00           3.045810D-01
                  4.133734D+00           3.862990D-01
                  1.747518D+00          -5.837500D-02
                  6.995600D-01          -5.388760D-01
                  2.516080D-01          -3.454730D-01
            D    1   1.00
                  2.516080D-01           1.000000D+00
            D    1   1.00
                  9.049000D-02           1.000000D+00
            F    2   1.00
                  5.734400D+00           4.311320D-01
                  1.461500D+00           7.546420D-01
            F    1   1.00
                  5.486100D-01           1.000000D+00
            ****
            -Ga     0
            S    14   1.00
                  4.851300D+05           2.068000D-04
                  7.271900D+04           1.604700D-03
                  1.655200D+04           8.340200D-03
                  4.687800D+03           3.402480D-02
                  1.529100D+03           1.111699D-01
                  5.518100D+02           2.753930D-01
                  2.151800D+02           4.212628D-01
                  8.817400D+01           2.738906D-01
                  2.715400D+01           2.837200D-02
                  1.150300D+01          -6.293100D-03
                  3.301800D+00           2.060600D-03
                  1.331400D+00          -9.269000D-04
                  1.931600D-01           2.273000D-04
                  7.089500D-02          -1.063000D-04
            S    14   1.00
                  4.851300D+05          -6.430000D-05
                  7.271900D+04          -4.954000D-04
                  1.655200D+04          -2.620800D-03
                  4.687800D+03          -1.068390D-02
                  1.529100D+03          -3.741230D-02
                  5.518100D+02          -1.009636D-01
                  2.151800D+02          -2.145141D-01
                  8.817400D+01          -1.752297D-01
                  2.715400D+01           4.831599D-01
                  1.150300D+01           6.323677D-01
                  3.301800D+00           6.849420D-02
                  1.331400D+00          -1.187120D-02
                  1.931600D-01           2.665200D-03
                  7.089500D-02          -1.225100D-03
            S    14   1.00
                  4.851300D+05           2.450000D-05
                  7.271900D+04           1.895000D-04
                  1.655200D+04           9.964000D-04
                  4.687800D+03           4.108200D-03
                  1.529100D+03           1.429380D-02
                  5.518100D+02           3.980340D-02
                  2.151800D+02           8.559400D-02
                  8.817400D+01           7.963050D-02
                  2.715400D+01          -2.939107D-01
                  1.150300D+01          -5.263914D-01
                  3.301800D+00           5.864249D-01
                  1.331400D+00           6.726347D-01
                  1.931600D-01           2.761230D-02
                  7.089500D-02          -9.365100D-03
            S    14   1.00
                  4.851300D+05          -5.700000D-06
                  7.271900D+04          -4.400000D-05
                  1.655200D+04          -2.305000D-04
                  4.687800D+03          -9.544000D-04
                  1.529100D+03          -3.305500D-03
                  5.518100D+02          -9.288800D-03
                  2.151800D+02          -1.986440D-02
                  8.817400D+01          -1.908880D-02
                  2.715400D+01           7.323560D-02
                  1.150300D+01           1.341526D-01
                  3.301800D+00          -1.831929D-01
                  1.331400D+00          -3.571308D-01
                  1.931600D-01           6.246013D-01
                  7.089500D-02           5.238430D-01
            S    1   1.00
                  7.089500D-02           1.000000D+00
            S    1   1.00
                  0.0243480              1.0000000
            P    11   1.00
                  3.248600D+03           1.526000D-03
                  7.699700D+02           1.274860D-02
                  2.482000D+02           6.337420D-02
                  9.336400D+01           2.065775D-01
                  3.825100D+01           4.092963D-01
                  1.642200D+01           3.919183D-01
                  6.791800D+00           1.029441D-01
                  2.833600D+00          -7.203000D-04
                  1.106200D+00           2.095000D-03
                  2.225000D-01          -3.290000D-04
                  6.177200D-02           1.162000D-04
            P    11   1.00
                  3.248600D+03          -5.803000D-04
                  7.699700D+02          -4.864700D-03
                  2.482000D+02          -2.483940D-02
                  9.336400D+01          -8.417590D-02
                  3.825100D+01          -1.800885D-01
                  1.642200D+01          -1.585555D-01
                  6.791800D+00           2.355376D-01
                  2.833600D+00           5.820587D-01
                  1.106200D+00           3.366619D-01
                  2.225000D-01           1.719120D-02
                  6.177200D-02          -3.326500D-03
            P    11   1.00
                  3.248600D+03           9.500000D-05
                  7.699700D+02           7.832000D-04
                  2.482000D+02           4.085500D-03
                  9.336400D+01           1.359870D-02
                  3.825100D+01           3.026950D-02
                  1.642200D+01           2.417900D-02
                  6.791800D+00          -4.237770D-02
                  2.833600D+00          -1.265661D-01
                  1.106200D+00          -4.994440D-02
                  2.225000D-01           4.494199D-01
                  6.177200D-02           6.718899D-01
            P    1   1.00
                  6.177200D-02           1.000000D+00
            P    1   1.00
                  0.0151640              1.0000000
            D    5   1.00
                  6.533700D+01           2.738250D-02
                  1.849700D+01           1.510805D-01
                  6.315000D+00           3.749217D-01
                  2.163500D+00           4.750799D-01
                  6.667500D-01           2.982750D-01
            D    1   1.00
                  1.884000D-01           1.000000D+00
            D    1   1.00
                  0.0537000              1.0000000
            ****
            -Ge     0
            S    14   1.00
                  5.218000D+05           2.045000D-04
                  7.821400D+04           1.586800D-03
                  1.780300D+04           8.248000D-03
                  5.041900D+03           3.366490D-02
                  1.644500D+03           1.101249D-01
                  5.934300D+02           2.735607D-01
                  2.313600D+02           4.210670D-01
                  9.476200D+01           2.766791D-01
                  2.927400D+01           2.921800D-02
                  1.245000D+01          -6.590300D-03
                  3.646300D+00           2.243000D-03
                  1.502500D+00          -1.038200D-03
                  2.450300D-01           2.695000D-04
                  9.159400D-02          -1.228000D-04
            S    14   1.00
                  5.218000D+05          -6.380000D-05
                  7.821400D+04          -4.916000D-04
                  1.780300D+04          -2.600200D-03
                  5.041900D+03          -1.060800D-02
                  1.644500D+03          -3.716020D-02
                  5.934300D+02          -1.005790D-01
                  2.313600D+02          -2.143977D-01
                  9.476200D+01          -1.782617D-01
                  2.927400D+01           4.777404D-01
                  1.245000D+01           6.355983D-01
                  3.646300D+00           7.221740D-02
                  1.502500D+00          -1.272650D-02
                  2.450300D-01           2.960800D-03
                  9.159400D-02          -1.329200D-03
            S    14   1.00
                  5.218000D+05           2.460000D-05
                  7.821400D+04           1.900000D-04
                  1.780300D+04           9.993000D-04
                  5.041900D+03           4.120000D-03
                  1.644500D+03           1.435570D-02
                  5.934300D+02           4.003750D-02
                  2.313600D+02           8.657940D-02
                  9.476200D+01           8.158610D-02
                  2.927400D+01          -2.934770D-01
                  1.245000D+01          -5.367983D-01
                  3.646300D+00           5.637985D-01
                  1.502500D+00           6.947182D-01
                  2.450300D-01           3.157300D-02
                  9.159400D-02          -9.894900D-03
            S    14   1.00
                  5.218000D+05          -6.300000D-06
                  7.821400D+04          -4.860000D-05
                  1.780300D+04          -2.553000D-04
                  5.041900D+03          -1.056000D-03
                  1.644500D+03          -3.667400D-03
                  5.934300D+02          -1.030530D-02
                  2.313600D+02          -2.222000D-02
                  9.476200D+01          -2.152750D-02
                  2.927400D+01           8.067520D-02
                  1.245000D+01           1.524958D-01
                  3.646300D+00          -1.980528D-01
                  1.502500D+00          -4.073954D-01
                  2.450300D-01           6.477288D-01
                  9.159400D-02           5.222033D-01
            S    1   1.00
                  9.159400D-02           1.000000D+00
            S    1   1.00
                  0.0339610              1.0000000
            P    11   1.00
                  3.568100D+03           1.459100D-03
                  8.457200D+02           1.221760D-02
                  2.727400D+02           6.104900D-02
                  1.026800D+02           2.008039D-01
                  4.214800D+01           4.038942D-01
                  1.814900D+01           3.970027D-01
                  7.593400D+00           1.105481D-01
                  3.196400D+00           7.680000D-05
                  1.274300D+00           2.126300D-03
                  2.825800D-01          -3.744000D-04
                  8.409000D-02           1.321000D-04
            P    11   1.00
                  3.568100D+03          -5.630000D-04
                  8.457200D+02          -4.735400D-03
                  2.727400D+02          -2.426430D-02
                  1.026800D+02          -8.309000D-02
                  4.214800D+01          -1.800247D-01
                  1.814900D+01          -1.663295D-01
                  7.593400D+00           2.193717D-01
                  3.196400D+00           5.820239D-01
                  1.274300D+00           3.477720D-01
                  2.825800D-01           1.924550D-02
                  8.409000D-02          -3.482500D-03
            P    11   1.00
                  3.568100D+03           1.115000D-04
                  8.457200D+02           9.212000D-04
                  2.727400D+02           4.827300D-03
                  1.026800D+02           1.622720D-02
                  4.214800D+01           3.663540D-02
                  1.814900D+01           3.078670D-02
                  7.593400D+00          -4.806430D-02
                  3.196400D+00          -1.559804D-01
                  1.274300D+00          -6.323700D-02
                  2.825800D-01           5.040819D-01
                  8.409000D-02           6.182200D-01
            P    1   1.00
                  8.409000D-02           1.000000D+00
            P    1   1.00
                  0.0239450              1.0000000
            D    5   1.00
                  7.476200D+01           2.576840D-02
                  2.130200D+01           1.454421D-01
                  7.343600D+00           3.713721D-01
                  2.565100D+00           4.800002D-01
                  8.197000D-01           2.896800D-01
            D    1   1.00
                  2.470000D-01           1.000000D+00
            D    1   1.00
                  0.0771000              1.0000000
            ****
            -As     0
            S    14   1.00
                  5.595838D+05           2.024000D-04
                  8.387933D+04           1.570900D-03
                  1.909267D+04           8.166200D-03
                  5.407392D+03           3.333990D-02
                  1.763756D+03           1.091726D-01
                  6.364567D+02           2.718853D-01
                  2.480884D+02           4.208509D-01
                  1.015785D+02           2.792257D-01
                  3.147551D+01           3.003010D-02
                  1.343728D+01          -6.880400D-03
                  4.008690D+00           2.424000D-03
                  1.684929D+00          -1.149100D-03
                  3.000190D-01           3.095000D-04
                  1.135870D-01          -1.377000D-04
            S    14   1.00
                  5.595838D+05          -6.340000D-05
                  8.387933D+04          -4.883000D-04
                  1.909267D+04          -2.582100D-03
                  5.407392D+03          -1.054020D-02
                  1.763756D+03          -3.693250D-02
                  6.364567D+02          -1.002355D-01
                  2.480884D+02          -2.142948D-01
                  1.015785D+02          -1.810526D-01
                  3.147551D+01           4.725410D-01
                  1.343728D+01           6.386194D-01
                  4.008690D+00           7.581070D-02
                  1.684929D+00          -1.352780D-02
                  3.000190D-01           3.197000D-03
                  1.135870D-01          -1.405600D-03
            S    14   1.00
                  5.595838D+05           2.460000D-05
                  8.387933D+04           1.907000D-04
                  1.909267D+04           1.003100D-03
                  5.407392D+03           4.135300D-03
                  1.763756D+03           1.442590D-02
                  6.364567D+02           4.029620D-02
                  2.480884D+02           8.756700D-02
                  1.015785D+02           8.351780D-02
                  3.147551D+01          -2.932935D-01
                  1.343728D+01          -5.470520D-01
                  4.008690D+00           5.438738D-01
                  1.684929D+00           7.143591D-01
                  3.000190D-01           3.534430D-02
                  1.135870D-01          -1.028920D-02
            S    14   1.00
                  5.595838D+05          -6.800000D-06
                  8.387933D+04          -5.250000D-05
                  1.909267D+04          -2.756000D-04
                  5.407392D+03          -1.138900D-03
                  1.763756D+03          -3.964600D-03
                  6.364567D+02          -1.114230D-02
                  2.480884D+02          -2.419910D-02
                  1.015785D+02          -2.363390D-02
                  3.147551D+01           8.663170D-02
                  1.343728D+01           1.685839D-01
                  4.008690D+00          -2.091425D-01
                  1.684929D+00          -4.500918D-01
                  3.000190D-01           6.603978D-01
                  1.135870D-01           5.284152D-01
            S    1   1.00
                  1.135870D-01           1.000000D+00
            S    1   1.00
                  0.0411520              1.0000000
            P    11   1.00
                  3.886356D+03           1.409700D-03
                  9.212020D+02           1.182770D-02
                  2.971932D+02           5.932800D-02
                  1.119751D+02           1.965115D-01
                  4.603462D+01           3.997891D-01
                  1.987419D+01           4.004653D-01
                  8.386088D+00           1.164196D-01
                  3.558728D+00           6.918000D-04
                  1.447282D+00           2.163300D-03
                  3.477790D-01          -4.150000D-04
                  1.076990D-01           1.452000D-04
            P    11   1.00
                  3.886356D+03          -5.519000D-04
                  9.212020D+02          -4.655000D-03
                  2.971932D+02          -2.391760D-02
                  1.119751D+02          -8.256270D-02
                  4.603462D+01          -1.806791D-01
                  1.987419D+01          -1.724848D-01
                  8.386088D+00           2.086700D-01
                  3.558728D+00           5.823622D-01
                  1.447282D+00           3.537465D-01
                  3.477790D-01           2.064390D-02
                  1.076990D-01          -3.638200D-03
            P    11   1.00
                  3.886356D+03           1.236000D-04
                  9.212020D+02           1.024000D-03
                  2.971932D+02           5.380500D-03
                  1.119751D+02           1.824430D-02
                  4.603462D+01           4.159790D-02
                  1.987419D+01           3.629980D-02
                  8.386088D+00          -5.235690D-02
                  3.558728D+00          -1.791667D-01
                  1.447282D+00          -7.404770D-02
                  3.477790D-01           5.358094D-01
                  1.076990D-01           5.888104D-01
            P    1   1.00
                  1.076990D-01           1.000000D+00
            P    1   1.00
                  0.0312680              1.0000000
            D    5   1.00
                  8.442423D+01           2.452880D-02
                  2.418159D+01           1.411340D-01
                  8.401777D+00           3.687579D-01
                  2.980502D+00           4.840626D-01
                  9.790030D-01           2.824434D-01
            D    1   1.00
                  3.098000D-01           1.000000D+00
            D    1   1.00
                  0.1078000              1.0000000
            ****
            -Se     0
            S    14   1.00
                  5.989900D+05           2.004000D-04
                  8.978300D+04           1.555400D-03
                  2.043500D+04           8.087200D-03
                  5.786900D+03           3.303440D-02
                  1.887300D+03           1.082924D-01
                  6.809700D+02           2.703361D-01
                  2.653900D+02           4.206236D-01
                  1.086300D+02           2.815922D-01
                  3.376000D+01           3.081100D-02
                  1.446500D+01          -7.161700D-03
                  4.389000D+00           2.602200D-03
                  1.878300D+00          -1.258300D-03
                  3.585900D-01           3.465000D-04
                  1.364900D-01          -1.503000D-04
            S    14   1.00
                  5.989900D+05          -6.290000D-05
                  8.978300D+04          -4.850000D-04
                  2.043500D+04          -2.564400D-03
                  5.786900D+03          -1.047610D-02
                  1.887300D+03          -3.672230D-02
                  6.809700D+02          -9.992250D-02
                  2.653900D+02          -2.141973D-01
                  1.086300D+02          -1.836593D-01
                  3.376000D+01           4.675454D-01
                  1.446500D+01           6.414740D-01
                  4.389000D+00           7.925690D-02
                  1.878300D+00          -1.426970D-02
                  3.585900D-01           3.379200D-03
                  1.364900D-01          -1.453700D-03
            S    14   1.00
                  5.989900D+05           2.470000D-05
                  8.978300D+04           1.913000D-04
                  2.043500D+04           1.006800D-03
                  5.786900D+03           4.151400D-03
                  1.887300D+03           1.449910D-02
                  6.809700D+02           4.056580D-02
                  2.653900D+02           8.853640D-02
                  1.086300D+02           8.542120D-02
                  3.376000D+01          -2.932581D-01
                  1.446500D+01          -5.570727D-01
                  4.389000D+00           5.261436D-01
                  1.878300D+00           7.320371D-01
                  3.585900D-01           3.882460D-02
                  1.364900D-01          -1.050360D-02
            S    14   1.00
                  5.989900D+05          -7.200000D-06
                  8.978300D+04          -5.590000D-05
                  2.043500D+04          -2.938000D-04
                  5.786900D+03          -1.213600D-03
                  1.887300D+03          -4.234000D-03
                  6.809700D+02          -1.190350D-02
                  2.653900D+02          -2.602060D-02
                  1.086300D+02          -2.561480D-02
                  3.376000D+01           9.194270D-02
                  1.446500D+01           1.838700D-01
                  4.389000D+00          -2.188461D-01
                  1.878300D+00          -4.896524D-01
                  3.585900D-01           6.775818D-01
                  1.364900D-01           5.296721D-01
            S    1   1.00
                  1.364900D-01           1.000000D+00
            S    1   1.00
                  0.0487470              1.0000000
            P    11   1.00
                  4.135600D+03           1.412700D-03
                  9.803400D+02           1.185880D-02
                  3.163500D+02           5.951530D-02
                  1.192500D+02           1.972201D-01
                  4.906800D+01           4.007439D-01
                  2.121200D+01           3.994740D-01
                  8.946200D+00           1.153364D-01
                  3.823600D+00           2.219000D-04
                  1.588300D+00           2.283800D-03
                  4.096900D-01          -4.756000D-04
                  1.245900D-01           1.516000D-04
            P    11   1.00
                  4.135600D+03          -5.610000D-04
                  9.803400D+02          -4.734000D-03
                  3.163500D+02          -2.435040D-02
                  1.192500D+02          -8.410710D-02
                  4.906800D+01          -1.841384D-01
                  2.121200D+01          -1.735004D-01
                  8.946200D+00           2.167263D-01
                  3.823600D+00           5.850099D-01
                  1.588300D+00           3.416816D-01
                  4.096900D-01           1.991250D-02
                  1.245900D-01          -2.613100D-03
            P    11   1.00
                  4.135600D+03           1.366000D-04
                  9.803400D+02           1.130800D-03
                  3.163500D+02           5.958100D-03
                  1.192500D+02           2.018660D-02
                  4.906800D+01           4.619390D-02
                  2.121200D+01           3.940500D-02
                  8.946200D+00          -5.928460D-02
                  3.823600D+00          -2.014663D-01
                  1.588300D+00          -6.878210D-02
                  4.096900D-01           5.595944D-01
                  1.245900D-01           5.709784D-01
            P    1   1.00
                  1.245900D-01           1.000000D+00
            P    1   1.00
                  0.0354920              1.0000000
            D    5   1.00
                  9.447200D+01           2.349820D-02
                  2.718000D+01           1.375183D-01
                  9.506800D+00           3.664824D-01
                  3.416800D+00           4.874717D-01
                  1.147900D+00           2.765769D-01
            D    1   1.00
                  3.682000D-01           1.000000D+00
            D    1   1.00
                  0.1283000              1.0000000
            ****
            -Br     0
            S    14   1.00
                  6.401000D+05           1.984000D-04
                  9.593800D+04           1.540000D-03
                  2.183300D+04           8.009600D-03
                  6.181900D+03           3.273410D-02
                  2.015700D+03           1.074480D-01
                  7.271000D+02           2.688946D-01
                  2.832800D+02           4.204411D-01
                  1.159100D+02           2.838041D-01
                  3.612400D+01           3.154550D-02
                  1.553200D+01          -7.426800D-03
                  4.785700D+00           2.772800D-03
                  2.081700D+00          -1.363500D-03
                  4.202800D-01           3.812000D-04
                  1.606900D-01          -1.615000D-04
            S    14   1.00
                  6.401000D+05          -6.250000D-05
                  9.593800D+04          -4.816000D-04
                  2.183300D+04          -2.546600D-03
                  6.181900D+03          -1.041120D-02
                  2.015700D+03          -3.651790D-02
                  7.271000D+02          -9.962950D-02
                  2.832800D+02          -2.141310D-01
                  1.159100D+02          -1.860911D-01
                  3.612400D+01           4.628261D-01
                  1.553200D+01           6.441141D-01
                  4.785700D+00           8.255020D-02
                  2.081700D+00          -1.496940D-02
                  4.202800D-01           3.528800D-03
                  1.606900D-01          -1.490900D-03
            S    14   1.00
                  6.401000D+05           2.480000D-05
                  9.593800D+04           1.919000D-04
                  2.183300D+04           1.010000D-03
                  6.181900D+03           4.165900D-03
                  2.015700D+03           1.456830D-02
                  7.271000D+02           4.083450D-02
                  2.832800D+02           8.948590D-02
                  1.159100D+02           8.727860D-02
                  3.612400D+01          -2.933644D-01
                  1.553200D+01          -5.667109D-01
                  4.785700D+00           5.105658D-01
                  2.081700D+00           7.477214D-01
                  4.202800D-01           4.215120D-02
                  1.606900D-01          -1.066120D-02
            S    14   1.00
                  6.401000D+05          -7.600000D-06
                  9.593800D+04          -5.880000D-05
                  2.183300D+04          -3.092000D-04
                  6.181900D+03          -1.276600D-03
                  2.015700D+03          -4.463400D-03
                  7.271000D+02          -1.255750D-02
                  2.832800D+02          -2.761450D-02
                  1.159100D+02          -2.739450D-02
                  3.612400D+01           9.640940D-02
                  1.553200D+01           1.976871D-01
                  4.785700D+00          -2.266693D-01
                  2.081700D+00          -5.241165D-01
                  4.202800D-01           6.889865D-01
                  1.606900D-01           5.344331D-01
            S    1   1.00
                  1.606900D-01           1.000000D+00
            S    1   1.00
                  0.0569460              1.0000000
            P    11   1.00
                  4.340800D+03           1.444800D-03
                  1.028900D+03           1.212880D-02
                  3.320200D+02           6.080770D-02
                  1.251600D+02           2.009358D-01
                  5.151100D+01           4.047419D-01
                  2.228100D+01           3.957151D-01
                  9.341700D+00           1.102213D-01
                  4.013200D+00          -9.090000D-04
                  1.700200D+00           2.483200D-03
                  4.719400D-01          -5.744000D-04
                  1.442100D-01           1.691000D-04
            P    11   1.00
                  4.340800D+03          -5.819000D-04
                  1.028900D+03          -4.906500D-03
                  3.320200D+02          -2.525140D-02
                  1.251600D+02          -8.694450D-02
                  5.151100D+01          -1.893422D-01
                  2.228100D+01          -1.710882D-01
                  9.341700D+00           2.368755D-01
                  4.013200D+00           5.898400D-01
                  1.700200D+00           3.171944D-01
                  4.719400D-01           1.798330D-02
                  1.442100D-01          -1.468300D-03
            P    11   1.00
                  4.340800D+03           1.518000D-04
                  1.028900D+03           1.256300D-03
                  3.320200D+02           6.622400D-03
                  1.251600D+02           2.238160D-02
                  5.151100D+01           5.097170D-02
                  2.228100D+01           4.140090D-02
                  9.341700D+00          -7.039700D-02
                  4.013200D+00          -2.232540D-01
                  1.700200D+00          -5.641790D-02
                  4.719400D-01           5.808079D-01
                  1.442100D-01           5.508132D-01
            P    1   1.00
                  1.442100D-01           1.000000D+00
            P    1   1.00
                  0.0410490              1.0000000
            D    5   1.00
                  1.048300D+02           2.265830D-02
                  3.027200D+01           1.345895D-01
                  1.064900D+01           3.647181D-01
                  3.869600D+00           4.904196D-01
                  1.323900D+00           2.713885D-01
            D    1   1.00
                  4.098000D-01           1.000000D+00
            D    1   1.00
                  0.1719000              1.0000000
            ****
            -Kr     0
            S    14   1.00
                  6.813588D+05           1.969000D-04
                  1.021265D+05           1.528600D-03
                  2.324371D+04           7.950000D-03
                  6.582007D+03           3.249380D-02
                  2.146429D+03           1.067240D-01
                  7.743378D+02           2.675701D-01
                  3.016702D+02           4.201851D-01
                  1.234118D+02           2.858015D-01
                  3.856755D+01           3.224610D-02
                  1.663738D+01          -7.682800D-03
                  5.198795D+00           2.939300D-03
                  2.294814D+00          -1.466200D-03
                  4.852110D-01           4.144000D-04
                  1.862700D-01          -1.720000D-04
            S    14   1.00
                  6.813588D+05          -6.220000D-05
                  1.021265D+05          -4.794000D-04
                  2.324371D+04          -2.534100D-03
                  6.582007D+03          -1.036360D-02
                  2.146429D+03          -3.635160D-02
                  7.743378D+02          -9.937370D-02
                  3.016702D+02          -2.140610D-01
                  1.234118D+02          -1.883192D-01
                  3.856755D+01           4.583816D-01
                  1.663738D+01           6.465664D-01
                  5.198795D+00           8.565790D-02
                  2.294814D+00          -1.561230D-02
                  4.852110D-01           3.649000D-03
                  1.862700D-01          -1.518900D-03
            S    14   1.00
                  6.813588D+05           2.490000D-05
                  1.021265D+05           1.928000D-04
                  2.324371D+04           1.014900D-03
                  6.582007D+03           4.185700D-03
                  2.146429D+03           1.464590D-02
                  7.743378D+02           4.110700D-02
                  3.016702D+02           9.039550D-02
                  1.234118D+02           8.906230D-02
                  3.856755D+01          -2.935718D-01
                  1.663738D+01          -5.759698D-01
                  5.198795D+00           4.968578D-01
                  2.294814D+00           7.616895D-01
                  4.852110D-01           4.532670D-02
                  1.862700D-01          -1.077220D-02
            S    14   1.00
                  6.813588D+05          -7.900000D-06
                  1.021265D+05          -6.140000D-05
                  2.324371D+04          -3.230000D-04
                  6.582007D+03          -1.333000D-03
                  2.146429D+03          -4.667200D-03
                  7.743378D+02          -1.313520D-02
                  3.016702D+02          -2.903420D-02
                  1.234118D+02          -2.901730D-02
                  3.856755D+01           1.002664D-01
                  1.663738D+01           2.103818D-01
                  5.198795D+00          -2.332471D-01
                  2.294814D+00          -5.546497D-01
                  4.852110D-01           6.969522D-01
                  1.862700D-01           5.408152D-01
            S    1   1.00
                  1.862700D-01           1.000000D+00
            S    1   1.00
                  0.0651450              1.0000000
            P    11   1.00
                  4.474270D+03           1.519500D-03
                  1.060579D+03           1.274240D-02
                  3.422081D+02           6.364650D-02
                  1.289984D+02           2.085635D-01
                  5.308722D+01           4.122423D-01
                  2.295942D+01           3.878103D-01
                  9.507300D+00           1.003820D-01
                  4.083055D+00          -2.507800D-03
                  1.750446D+00           2.713900D-03
                  5.291900D-01          -6.977000D-04
                  1.643690D-01           2.107000D-04
            P    11   1.00
                  4.474270D+03          -6.208000D-04
                  1.060579D+03          -5.221200D-03
                  3.422081D+02          -2.684630D-02
                  1.289984D+02          -9.158230D-02
                  5.308722D+01          -1.968164D-01
                  2.295942D+01          -1.634750D-01
                  9.507300D+00           2.738204D-01
                  4.083055D+00           5.981592D-01
                  1.750446D+00           2.750453D-01
                  5.291900D-01           1.277060D-02
                  1.643690D-01          -1.013500D-03
            P    11   1.00
                  4.474270D+03           1.701000D-04
                  1.060579D+03           1.406400D-03
                  3.422081D+02           7.396300D-03
                  1.289984D+02           2.482540D-02
                  5.308722D+01           5.571550D-02
                  2.295942D+01           4.121320D-02
                  9.507300D+00          -8.760570D-02
                  4.083055D+00          -2.440586D-01
                  1.750446D+00          -2.950070D-02
                  5.291900D-01           6.012295D-01
                  1.643690D-01           5.254807D-01
            P    1   1.00
                  1.643690D-01           1.000000D+00
            P    1   1.00
                  0.0466060              1.0000000
            D    5   1.00
                  1.155253D+02           2.195570D-02
                  3.346525D+01           1.321620D-01
                  1.183046D+01           3.633484D-01
                  4.339771D+00           4.929582D-01
                  1.507524D+00           2.667560D-01
            D    1   1.00
                  5.030000D-01           1.000000D+00
            D    1   1.00
                  0.2155000              1.0000000
            ****
            -Y     0
            S    7   1.00
                 29.2935000              0.0066660
                 16.6827000             -0.0497340
                 10.4235000              0.1315590
                  3.0952600             -0.5243820
                  0.7079710              0.7863790
                  0.3225670              0.4639580
                  0.0690850              0.0204860
            S    7   1.00
                 29.2935000             -0.0013580
                 16.6827000              0.0123920
                 10.4235000             -0.0375720
                  3.0952600              0.1741090
                  0.7079710             -0.3385090
                  0.3225670             -0.3354170
                  0.0690850              0.6581470
            S    7   1.00
                 29.2935000              0.0112420
                 16.6827000             -0.0574010
                 10.4235000              0.1106480
                  3.0952600             -0.3769430
                  0.7079710              1.2026360
                  0.3225670             -0.4875820
                  0.0690850             -1.8636390
            S    1   1.00
                  0.0274150              1.0000000
            S    1   1.00
                  0.0109000              1.0000000
            P    6   1.00
                  9.0271500              0.0203960
                  4.0242700             -0.1536620
                  0.9906740              0.4320820
                  0.4727970              0.4983480
                  0.2197340              0.1957420
                  0.0800880              0.0140830
            P    6   1.00
                  9.0271500             -0.0056190
                  4.0242700              0.0465110
                  0.9906740             -0.1495270
                  0.4727970             -0.2243370
                  0.2197340             -0.0114700
                  0.0800880              0.6364970
            P    6   1.00
                  9.0271500              0.0111310
                  4.0242700             -0.0963010
                  0.9906740              0.2986850
                  0.4727970              0.8892190
                  0.2197340             -1.4854780
                  0.0800880             -0.1131120
            P    1   1.00
                  0.0306400              1.0000000
            P    1   1.00
                  0.0117000              1.0000000
            D    5   1.00
                  4.3045000             -0.0043910
                  1.3201900              0.1196820
                  0.5614050              0.2962740
                  0.2267020              0.3908730
                  0.0879490              0.3539610
            D    5   1.00
                  4.3045000              0.0044330
                  1.3201900             -0.1499100
                  0.5614050             -0.3732930
                  0.2267020             -0.3129870
                  0.0879490              0.4218970
            D    1   1.00
                  0.0323050              1.0000000
            D    1   1.00
                  0.0119000              1.0000000
            F    1   1.00
                  0.2028000              1.0000000
            F    1   1.00
                  0.0484000              1.0000000
            ****
            -Zr     0
            S    7   1.00
                 53.4460000              0.0014860
                 17.0981000             -0.0365920
                 10.6875000              0.1321550
                  3.3913400             -0.5464540
                  0.7884750              0.8022910
                  0.3599820              0.4583040
                  0.0777920              0.0203880
            S    7   1.00
                 53.4460000             -0.0003080
                 17.0981000              0.0096310
                 10.6875000             -0.0390430
                  3.3913400              0.1847170
                  0.7884750             -0.3584690
                  0.3599820             -0.3208280
                  0.0777920              0.6560480
            S    7   1.00
                 53.4460000              0.0028110
                 17.0981000             -0.0412920
                 10.6875000              0.1148910
                  3.3913400             -0.4348090
                  0.7884750              1.4174320
                  0.3599820             -0.7286190
                  0.0777920             -1.6769590
            S    1   1.00
                  0.0302340              1.0000000
            S    1   1.00
                  0.0118000              1.0000000
            P    6   1.00
                  9.9011600              0.0214360
                  4.4181900             -0.1604130
                  1.0931000              0.4543260
                  0.5187860              0.4991190
                  0.2363630              0.1777830
                  0.0847070              0.0104040
            P    6   1.00
                  9.9011600             -0.0058310
                  4.4181900              0.0481520
                  1.0931000             -0.1600800
                  0.5187860             -0.2201350
                  0.2363630              0.0355150
                  0.0847070              0.6181780
            P    6   1.00
                  9.9011600             -0.0078290
                  4.4181900              0.0660080
                  1.0931000             -0.2113740
                  0.5187860             -0.3575490
                  0.2363630              0.1703870
                  0.0847070              0.8518400
            P    1   1.00
                  0.0311380              1.0000000
            P    1   1.00
                  0.0114000              1.0000000
            D    5   1.00
                  4.3948700             -0.0082920
                  1.5708900              0.1278490
                  0.6923540              0.3219090
                  0.2904140              0.3998190
                  0.1158780              0.3194760
            D    5   1.00
                  4.3948700              0.0084760
                  1.5708900             -0.1579890
                  0.6923540             -0.3979000
                  0.2904140             -0.2555990
                  0.1158780              0.4914180
            D    1   1.00
                  0.0429250              1.0000000
            D    1   1.00
                  0.0159000              1.0000000
            F    1   1.00
                  0.3272000              1.0000000
            F    1   1.00
                  0.0891000              1.0000000
            ****
            -Nb     0
            S    7   1.00
                 80.8096000              0.0008890
                 17.9220000             -0.0347930
                 11.2050000              0.1389100
                  3.6990100             -0.5655680
                  0.8712090              0.8147210
                  0.3974440              0.4547970
                  0.0854690              0.0200510
            S    7   1.00
                 80.8096000             -0.0002000
                 17.9220000              0.0093020
                 11.2050000             -0.0414910
                  3.6990100              0.1923710
                  0.8712090             -0.3713520
                  0.3974440             -0.3068350
                  0.0854690              0.6546160
            S    7   1.00
                 80.8096000              0.0015640
                 17.9220000             -0.0382840
                 11.2050000              0.1209450
                  3.6990100             -0.4647790
                  0.8712090              1.5031600
                  0.3974440             -0.8262330
                  0.0854690             -1.5845850
            S    1   1.00
                  0.0326640              1.0000000
            S    1   1.00
                  0.0125000              1.0000000
            P    6   1.00
                 10.6457000              0.0234360
                  4.8235100             -0.1683110
                  1.2030900              0.4693810
                  0.5695080              0.4980520
                  0.2569700              0.1675400
                  0.0929460              0.0087660
            P    6   1.00
                 10.6457000             -0.0064960
                  4.8235100              0.0513810
                  1.2030900             -0.1706080
                  0.5695080             -0.2198720
                  0.2569700              0.0561670
                  0.0929460              0.6165950
            P    6   1.00
                 10.6457000             -0.0091300
                  4.8235100              0.0732300
                  1.2030900             -0.2370360
                  0.5695080             -0.3685640
                  0.2569700              0.2364390
                  0.0929460              0.8267330
            P    1   1.00
                  0.0338800              1.0000000
            P    1   1.00
                  0.0123000              1.0000000
            D    5   1.00
                  4.5456300             -0.0104650
                  1.8272300              0.1305530
                  0.8257640              0.3347580
                  0.3551560              0.4020270
                  0.1447240              0.3008350
            D    5   1.00
                  4.5456300              0.0105280
                  1.8272300             -0.1615000
                  0.8257640             -0.4113720
                  0.3551560             -0.2117820
                  0.1447240              0.4861590
            D    1   1.00
                  0.0543230              1.0000000
            D    1   1.00
                  0.0204000              1.0000000
            F    1   1.00
                  0.4690000              1.0000000
            F    1   1.00
                  0.1387000              1.0000000
            ****
            -Mo     0
            S    7   1.00
                106.9780000              0.0007350
                 18.8824000             -0.0350900
                 11.8077000              0.1473480
                  4.0211800             -0.5833630
                  0.9568160              0.8256350
                  0.4356920              0.4523110
                  0.0925180              0.0190550
            S    7   1.00
                106.9780000             -0.0001760
                 18.8824000              0.0093320
                 11.8077000             -0.0438110
                  4.0211800              0.1972320
                  0.9568160             -0.3773110
                  0.4356920             -0.2939670
                  0.0925180              0.6498330
            S    7   1.00
                106.9780000              0.0011660
                 18.8824000             -0.0376070
                 11.8077000              0.1259800
                  4.0211800             -0.4752370
                  0.9568160              1.4989830
                  0.4356920             -0.8223450
                  0.0925180             -1.5606240
            S    1   1.00
                  0.0348540              1.0000000
            S    1   1.00
                  0.0131000              1.0000000
            P    6   1.00
                 11.4118000              0.0253450
                  5.2453500             -0.1752130
                  1.3188400              0.4812720
                  0.6229830              0.4972610
                  0.2791080              0.1595550
                  0.1005260              0.0075430
            P    6   1.00
                 11.4118000             -0.0070220
                  5.2453500              0.0533390
                  1.3188400             -0.1756430
                  0.6229830             -0.2162130
                  0.2791080              0.0679580
                  0.1005260              0.6128160
            P    6   1.00
                 11.4118000             -0.0104200
                  5.2453500              0.0798670
                  1.3188400             -0.2629000
                  0.6229830             -0.3651840
                  0.2791080              0.2866730
                  0.1005260              0.8002580
            P    1   1.00
                  0.0362770              1.0000000
            P    1   1.00
                  0.0131000              1.0000000
            D    5   1.00
                  5.2576100             -0.0147610
                  2.1046200              0.1319820
                  0.9582010              0.3470860
                  0.4140470              0.4054710
                  0.1684500              0.2880580
            D    5   1.00
                  5.2576100              0.0154390
                  2.1046200             -0.1606210
                  0.9582010             -0.4232290
                  0.4140470             -0.1923390
                  0.1684500              0.5314590
            D    1   1.00
                  0.0623420              1.0000000
            D    1   1.00
                  0.0231000              1.0000000
            F    1   1.00
                  0.6007000              1.0000000
            F    1   1.00
                  0.1850000              1.0000000
            ****
            -Tc     0
            S    7   1.00
                132.6560000              0.0006860
                 19.8986000             -0.0360010
                 12.4450000              0.1564650
                  4.3605000             -0.5995730
                  1.0443600              0.8357100
                  0.4741590              0.4490550
                  0.0987360              0.0183780
            S    7   1.00
                132.6560000             -0.0001680
                 19.8986000              0.0093110
                 12.4450000             -0.0455350
                  4.3605000              0.1986020
                  1.0443600             -0.3749740
                  0.4741590             -0.2817600
                  0.0987360              0.6329980
            S    7   1.00
                132.6560000              0.0009800
                 19.8986000             -0.0378410
                 12.4450000              0.1317670
                  4.3605000             -0.4834180
                  1.0443600              1.4848540
                  0.4741590             -0.8047310
                  0.0987360             -1.5511910
            S    1   1.00
                  0.0367360              1.0000000
            S    1   1.00
                  0.0137000              1.0000000
            P    6   1.00
                 12.1789000              0.0273140
                  5.6848400             -0.1814030
                  1.4398300              0.4908910
                  0.6789090              0.4965410
                  0.3025150              0.1532990
                  0.1073070              0.0067000
            P    6   1.00
                 12.1789000             -0.0074300
                  5.6848400              0.0541370
                  1.4398300             -0.1762270
                  0.6789090             -0.2096540
                  0.3025150              0.0734980
                  0.1073070              0.6070490
            P    6   1.00
                 12.1789000             -0.0116300
                  5.6848400              0.0854050
                  1.4398300             -0.2844050
                  0.6789090             -0.3578760
                  0.3025150              0.3260330
                  0.1073070              0.7801240
            P    1   1.00
                  0.0381770              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  5.7601300             -0.0164110
                  2.3642400              0.1344070
                  1.0887100              0.3547260
                  0.4740600              0.4044790
                  0.1936070              0.2788770
            D    5   1.00
                  5.7601300              0.0169910
                  2.3642400             -0.1548960
                  1.0887100             -0.4281920
                  0.4740600             -0.1789920
                  0.1936070              0.5346560
            D    1   1.00
                  0.0714600              1.0000000
            D    1   1.00
                  0.0264000              1.0000000
            F    1   1.00
                  0.7228000              1.0000000
            F    1   1.00
                  0.2272000              1.0000000
            ****
            -Ru     0
            S    7   1.00
                159.3720000              0.0006730
                 20.9016000             -0.0371610
                 13.0741000              0.1665170
                  4.7147400             -0.6159540
                  1.1361200              0.8428300
                  0.5154640              0.4477630
                  0.1067670              0.0184450
            S    7   1.00
                159.3720000             -0.0001690
                 20.9016000              0.0093920
                 13.0741000             -0.0477130
                  4.7147400              0.2011130
                  1.1361200             -0.3734210
                  0.5154640             -0.2738590
                  0.1067670              0.6093840
            S    7   1.00
                159.3720000              0.0008950
                 20.9016000             -0.0396350
                 13.0741000              0.1442430
                  4.7147400             -0.5192870
                  1.1361200              1.5854040
                  0.5154640             -0.9082030
                  0.1067670             -1.4720020
            S    1   1.00
                  0.0392180              1.0000000
            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                 12.8738000              0.0299680
                  6.1475000             -0.1879300
                  1.5652400              0.4999900
                  0.7361940              0.4957320
                  0.3263170              0.1475150
                  0.1124070              0.0060880
            P    6   1.00
                 12.8738000             -0.0078010
                  6.1475000              0.0536560
                  1.5652400             -0.1719400
                  0.7361940             -0.1991700
                  0.3263170              0.0744110
                  0.1124070              0.5971370
            P    6   1.00
                 12.8738000             -0.0135020
                  6.1475000              0.0937330
                  1.5652400             -0.3159100
                  0.7361940             -0.3618000
                  0.3263170              0.4008770
                  0.1124070              0.7537660
            P    1   1.00
                  0.0391720              1.0000000
            P    1   1.00
                  0.0137000              1.0000000
            D    5   1.00
                  6.2126500             -0.0245970
                  2.7853900              0.1273340
                  1.2685100              0.3570810
                  0.5517900              0.4082070
                  0.2247310              0.2812400
            D    5   1.00
                  6.2126500              0.0261160
                  2.7853900             -0.1459400
                  1.2685100             -0.4425210
                  0.5517900             -0.1690200
                  0.2247310              0.5052370
            D    1   1.00
                  0.0824110              1.0000000
            D    1   1.00
                  0.0302000              1.0000000
            F    1   1.00
                  0.8500000              1.0000000
            F    1   1.00
                  0.2719000              1.0000000
            ****
            -Rh     0
            S    7   1.00
                184.6660000              0.0006920
                 21.9974000             -0.0383930
                 13.7616000              0.1760190
                  5.0872000             -0.6299250
                  1.2294000              0.8495440
                  0.5568140              0.4457290
                  0.1140670              0.0182040
            S    7   1.00
                184.6660000             -0.0001780
                 21.9974000              0.0094560
                 13.7616000             -0.0494720
                  5.0872000              0.2018670
                  1.2294000             -0.3698090
                  0.5568140             -0.2653310
                  0.1140670              0.5891540
            S    7   1.00
                184.6660000              0.0008370
                 21.9974000             -0.0402860
                 13.7616000              0.1506490
                  5.0872000             -0.5268510
                  1.2294000              1.5723820
                  0.5568140             -0.8876430
                  0.1140670             -1.4709450
            S    1   1.00
                  0.0414150              1.0000000
            S    1   1.00
                  0.0150000              1.0000000
            P    6   1.00
                 13.6985000              0.0318210
                  6.6247600             -0.1930280
                  1.6961300              0.5062420
                  0.7973510              0.4949020
                  0.3520340              0.1440300
                  0.1233420              0.0056080
            P    6   1.00
                 13.6985000             -0.0085830
                  6.6247600              0.0568110
                  1.6961300             -0.1801720
                  0.7973510             -0.2034110
                  0.3520340              0.0848180
                  0.1233420              0.6010570
            P    6   1.00
                 13.6985000             -0.0151640
                  6.6247600              0.1011250
                  1.6961300             -0.3456410
                  0.7973510             -0.3454850
                  0.3520340              0.4221020
                  0.1233420              0.7304790
            P    1   1.00
                  0.0431300              1.0000000
            P    1   1.00
                  0.0151000              1.0000000
            D    5   1.00
                 18.7370000              0.0064810
                 11.7046000             -0.0139420
                  2.2555800              0.2506820
                  0.9494110              0.4511110
                  0.3661640              0.3839990
            D    5   1.00
                 18.7370000             -0.0075900
                 11.7046000              0.0162940
                  2.2555800             -0.3347730
                  0.9494110             -0.4463960
                  0.3661640              0.3299670
            D    1   1.00
                  0.1239770              1.0000000
            D    1   1.00
                  0.0420000              1.0000000
            F    1   1.00
                  0.9936000              1.0000000
            F    1   1.00
                  0.3222000              1.0000000
            ****
            -Pd     0
            S    7   1.00
                208.1230000              0.0007270
                 22.8525000             -0.0409280
                 14.2986000              0.1922850
                  5.4880100             -0.6501040
                  1.3253200              0.8565530
                  0.5989570              0.4438760
                  0.1209830              0.0178500
            S    7   1.00
                208.1230000             -0.0001890
                 22.8525000              0.0098180
                 14.2986000             -0.0528760
                  5.4880100              0.2035110
                  1.3253200             -0.3639350
                  0.5989570             -0.2582190
                  0.1209830              0.5704320
            S    7   1.00
                208.1230000              0.0008000
                 22.8525000             -0.0417810
                 14.2986000              0.1593620
                  5.4880100             -0.5231230
                  1.3253200              1.4917730
                  0.5989570             -0.7916960
                  0.1209830             -1.5172540
            S    1   1.00
                  0.0434590              1.0000000
            S    1   1.00
                  0.0156000              1.0000000
            P    6   1.00
                 14.0509000              0.0379970
                  7.1390600             -0.2040770
                  1.8300700              0.5137680
                  0.8583350              0.4942400
                  0.3772750              0.1402910
                  0.1256960              0.0051570
            P    6   1.00
                 14.0509000             -0.0093130
                  7.1390600              0.0546710
                  1.8300700             -0.1661610
                  0.8583350             -0.1858420
                  0.3772750              0.0731610
                  0.1256960              0.5861720
            P    6   1.00
                 14.0509000             -0.0186030
                  7.1390600              0.1098650
                  1.8300700             -0.3664000
                  0.8583350             -0.3473160
                  0.3772750              0.4820340
                  0.1256960              0.7096400
            P    1   1.00
                  0.0426590              1.0000000
            P    1   1.00
                  0.0145000              1.0000000
            D    5   1.00
                 19.2539000              0.0066240
                 10.5848000             -0.0184110
                  2.4561900              0.2633960
                  1.0352900              0.4524480
                  0.4020080              0.3758330
            D    5   1.00
                 19.2539000             -0.0078390
                 10.5848000              0.0218380
                  2.4561900             -0.3691550
                  1.0352900             -0.4309590
                  0.4020080              0.3749650
            D    1   1.00
                  0.1370570              1.0000000
            D    1   1.00
                  0.0467000              1.0000000
            F    1   1.00
                  1.1484000              1.0000000
            F    1   1.00
                  0.3788000              1.0000000
            ****
            -Ag     0
            S    8   1.00
                180.0750000              0.0008490
                 21.8987000             -0.0654500
                 13.8670000              0.2977650
                  6.1426300             -0.7531210
                  1.4381400              0.8811750
                  0.6483820              0.4351760
                  0.1288820              0.0147380
                  0.0457380             -0.0013990
            S    8   1.00
                180.0750000             -0.0002030
                 21.8987000              0.0157230
                 13.8670000             -0.0792290
                  6.1426300              0.2226340
                  1.4381400             -0.3491960
                  0.6483820             -0.2559780
                  0.1288820              0.5486660
                  0.0457380              0.6181030
            S    8   1.00
                180.0750000             -0.0008620
                 21.8987000              0.0525460
                 13.8670000             -0.2081000
                  6.1426300              0.5249720
                  1.4381400             -1.2701730
                  0.6483820              0.5393730
                  0.1288820              1.6533910
                  0.0457380             -1.5839750
            S    1   1.00
                  0.0457380              1.0000000
            S    1   1.00
                  0.0162000              1.0000000
            P    7   1.00
                 11.8751000              0.1162480
                  8.0024500             -0.3072860
                  2.0176600              0.5157360
                  0.9542300              0.5031040
                  0.4231180              0.1420950
                  0.1358850              0.0051530
                  0.0454010              0.0001040
            P    7   1.00
                 11.8751000             -0.0282840
                  8.0024500              0.0783470
                  2.0176600             -0.1567410
                  0.9542300             -0.1886250
                  0.4231180              0.0635650
                  0.1358850              0.5817780
                  0.0454010              0.4999110
            P    7   1.00
                 11.8751000             -0.0528570
                  8.0024500              0.1470390
                  2.0176600             -0.3129730
                  0.9542300             -0.3708280
                  0.4231180              0.4236290
                  0.1358850              0.7536550
                  0.0454010              0.0708700
            P    1   1.00
                  0.0454010              1.0000000
            P    1   1.00
                  0.0152000              1.0000000
            D    6   1.00
                 26.4320000              0.0034790
                 11.0345000             -0.0138480
                  2.7378700              0.2545990
                  1.1957500              0.4498490
                  0.4820420              0.3757380
                  0.1729080              0.1458790
            D    6   1.00
                 26.4320000             -0.0047330
                 11.0345000              0.0190700
                  2.7378700             -0.4332980
                  1.1957500             -0.4445680
                  0.4820420              0.4914420
                  0.1729080              0.5728660
            D    1   1.00
                  0.1729080              1.0000000
            D    1   1.00
                  0.0620000              1.0000000
            F    1   1.00
                  1.3299000              1.0000000
            F    1   1.00
                  0.4449000              1.0000000
            ****
            -Cd     0
            S    8   1.00
                223.8530000              0.0008710
                 23.0948000             -0.0643070
                 14.6522000              0.3013160
                  6.5704440             -0.7605240
                  1.5378300              0.8940710
                  0.6909840              0.4278790
                  0.1349130              0.0101880
                  0.0474420             -0.0024450
            S    8   1.00
                223.8530000             -0.0002290
                 23.0948000              0.0155940
                 14.6522000             -0.0810470
                  6.5704440              0.2272510
                  1.5378300             -0.3625630
                  0.6909840             -0.2507830
                  0.1349130              0.6135330
                  0.0474420              0.5582600
            S    8   1.00
                223.8530000              0.0010770
                 23.0948000             -0.0716490
                 14.6522000              0.2889750
                  6.5704440             -0.7315460
                  1.5378300              1.9768990
                  0.6909840             -1.3519510
                  0.1349130             -1.1186740
                  0.0474420              1.3026160
            S    1   1.00
                  0.0474420              1.0000000
            S    1   1.00
                  0.0167000              1.0000000
            P    7   1.00
                 13.7175000              0.0776160
                  8.4632200             -0.2579430
                  2.1182000              0.5352740
                  0.9892620              0.4963620
                  0.4317810              0.1231090
                  0.1391600              0.0032100
                  0.0461490              0.0003400
            P    7   1.00
                 13.7175000             -0.0180110
                  8.4632200              0.0637170
                  2.1182000             -0.1587410
                  0.9892620             -0.1762800
                  0.4317810              0.0710060
                  0.1391600              0.5775860
                  0.0461490              0.4994910
            P    7   1.00
                 13.7175000             -0.0307300
                  8.4632200              0.1087440
                  2.1182000             -0.2782310
                  0.9892620             -0.3293900
                  0.4317810              0.3546300
                  0.1391600              0.7814580
                  0.0461490              0.0852520
            P    1   1.00
                  0.0461490              1.0000000
            P    1   1.00
                  0.0153000              1.0000000
            D    6   1.00
                 31.6697000              0.0031630
                 12.2214000             -0.0117910
                  3.1219900              0.2411940
                  1.3894100              0.4489980
                  0.5732030              0.3802110
                  0.2117080              0.1445530
            D    6   1.00
                 31.6697000             -0.0048710
                 12.2214000              0.0185820
                  3.1219900             -0.4766730
                  1.3894100             -0.4576040
                  0.5732030              0.5714620
                  0.2117080              0.4973800
            D    1   1.00
                  0.2117080              1.0000000
            D    1   1.00
                  0.0782000              1.0000000
            F    1   1.00
                  1.5393000              1.0000000
            F    1   1.00
                  0.5177000              1.0000000
            ****
            -In     0
            S    8   1.00
                265.1310000              0.0007700
                 25.5694000             -0.0527910
                 16.0041000              0.2593430
                  6.8188500             -0.7392890
                  1.6667600              0.8857730
                  0.7692320              0.4425920
                  0.1704150              0.0115740
                  0.0622300             -0.0024510
            S    8   1.00
                265.1310000             -0.0002300
                 25.5694000              0.0140880
                 16.0041000             -0.0786150
                  6.8188500              0.2528640
                  1.6667600             -0.4155450
                  0.7692320             -0.2966470
                  0.1704150              0.6785780
                  0.0622300              0.5271290
            S    1   1.00
                  0.1704150              1.0000000
            S    1   1.00
                  0.0622300              1.0000000
            S    1   1.00
                  0.0203000              1.0000000
            P    6   1.00
                 14.4691000              0.0901770
                  9.2808300             -0.2676420
                  2.0820100              0.6644830
                  0.8443140              0.4616900
                  0.1869000              0.0270590
                  0.0547770             -0.0046770
            P    6   1.00
                 14.4691000             -0.0190230
                  9.2808300              0.0591570
                  2.0820100             -0.1807490
                  0.8443140             -0.1145820
                  0.1869000              0.4407390
                  0.0547770              0.6877890
            P    1   1.00
                  0.0547770              1.0000000
            P    1   1.00
                  0.0141000              1.0000000
            D    6   1.00
                 30.7879000              0.0057660
                 19.2555000             -0.0107080
                  3.1966200              0.2938600
                  1.3321000              0.5108690
                  0.5046190              0.3415190
                  0.1498000              0.0524650
            D    1   1.00
                  0.1498000              1.0000000
            D    1   1.00
                  0.0472000              1.0000000
            ****
            -Sn     0
            S    8   1.00
                380.3660000              0.0011650
                 28.5822000             -0.0260060
                 17.8892000              0.1660430
                  6.9286200             -0.6589140
                  1.7839100              0.8693360
                  0.8431380              0.4521320
                  0.2052280              0.0129730
                  0.0766360             -0.0024030
            S    8   1.00
                380.3660000             -0.0004420
                 28.5822000              0.0057020
                 17.8892000             -0.0528940
                  6.9286200              0.2520870
                  1.7839100             -0.4703430
                  0.8431380             -0.3161440
                  0.2052280              0.7206250
                  0.0766360              0.5111140
            S    1   1.00
                  0.2052280              1.0000000
            S    1   1.00
                  0.0766360              1.0000000
            S    1   1.00
                  0.0275000              1.0000000
            P    6   1.00
                 18.5489000              0.0370210
                  9.5669600             -0.1938660
                  2.2186100              0.6575940
                  0.9214590              0.4555060
                  0.2178580              0.0272160
                  0.0693200             -0.0046040
            P    6   1.00
                 18.5489000             -0.0090520
                  9.5669600              0.0517620
                  2.2186100             -0.2217430
                  0.9214590             -0.1242790
                  0.2178580              0.5218530
                  0.0693200              0.6099370
            P    1   1.00
                  0.0693200              1.0000000
            P    1   1.00
                  0.0209000              1.0000000
            D    6   1.00
                 38.5626000              0.0042610
                 21.7613000             -0.0068970
                  3.6611100              0.2762770
                  1.5583300              0.5143230
                  0.6095230              0.3445590
                  0.1897000              0.0515940
            D    1   1.00
                  0.1897000              1.0000000
            D    1   1.00
                  0.0649000              1.0000000
            ****
            -Sb     0
            S    8   1.00
                371.5840000              0.0015910
                 26.5392000             -0.0416840
                 16.6213000              0.2733430
                  7.7355100             -0.7676850
                  1.8923400              0.8994960
                  0.9104310              0.4313870
                  0.2442310              0.0128370
                  0.0923970             -0.0021730
            S    8   1.00
                371.5840000              0.0006540
                 26.5392000             -0.0109620
                 16.6213000              0.0938330
                  7.7355100             -0.3040090
                  1.8923400              0.5084090
                  0.9104310              0.3392390
                  0.2442310             -0.7347720
                  0.0923970             -0.5261340
            S    1   1.00
                  0.2442310              1.0000000
            S    1   1.00
                  0.0923970              1.0000000
            S    1   1.00
                  0.0327000              1.0000000
            P    6   1.00
                 16.0509000              0.0921570
                 10.2621000             -0.2755590
                  2.4283200              0.6586400
                  1.0336000              0.4668920
                  0.2594400              0.0285110
                  0.0861080             -0.0051550
            P    6   1.00
                 16.0509000             -0.0253130
                 10.2621000              0.0797960
                  2.4283200             -0.2420940
                  1.0336000             -0.1486050
                  0.2594400              0.5489440
                  0.0861080              0.5892910
            P    1   1.00
                  0.0861080              1.0000000
            P    1   1.00
                  0.0271000              1.0000000
            D    6   1.00
                 45.4785000              0.0032590
                 18.5114000             -0.0054970
                  3.9160000              0.2799530
                  1.7148200              0.5127510
                  0.6973190              0.3328720
                  0.2304000              0.0488430
            D    1   1.00
                  0.2304000              1.0000000
            D    1   1.00
                  0.0802000              1.0000000
            ****
            -Te     0
            S    8   1.00
               2111.1900000              0.0006120
                311.6910000              0.0032070
                 13.8226000              0.4055120
                  8.7174800             -0.9325880
                  1.9830300              0.9196570
                  0.9703770              0.4046710
                  0.2797650              0.0123660
                  0.1067760             -0.0016040
            S    8   1.00
               2111.1900000              0.0002510
                311.6910000              0.0014570
                 13.8226000              0.1637020
                  8.7174800             -0.3984550
                  1.9830300              0.5780740
                  0.9703770              0.3271240
                  0.2797650             -0.7846540
                  0.1067760             -0.4994510
            S    1   1.00
                  0.2797650              1.0000000
            S    1   1.00
                  0.1067760              1.0000000
            S    1   1.00
                  0.0369000              1.0000000
            P    6   1.00
                 17.0629000              0.0893400
                 10.8306000             -0.2711680
                  2.5938000              0.6620230
                  1.1267600              0.4607440
                  0.3001760              0.0288090
                  0.0975510             -0.0038630
            P    6   1.00
                 17.0629000             -0.0268610
                 10.8306000              0.0863040
                  2.5938000             -0.2735020
                  1.1267600             -0.1513900
                  0.3001760              0.5839760
                  0.0975510              0.5650140
            P    1   1.00
                  0.0975510              1.0000000
            P    1   1.00
                  0.0299000              1.0000000
            D    6   1.00
                 50.9106000              0.0033540
                 18.4647000             -0.0036420
                  4.2761700              0.2780800
                  1.8977000              0.5163480
                  0.7864800              0.3265710
                  0.2638000              0.0451520
            D    1   1.00
                  0.2638000              1.0000000
            D    1   1.00
                  0.0988000              1.0000000
            ****
            -I     0
            S    8   1.00
                  2.449790D+03           4.190000D-04
                  3.598080D+02           2.240000D-03
                  1.440580D+01           3.972230D-01
                  9.076320D+00          -9.322490D-01
                  2.088100D+00           9.371380D-01
                  1.034980D+00           3.920860D-01
                  3.162840D-01           1.248500D-02
                  1.217190D-01          -1.329000D-03
            S    8   1.00
                  2.449790D+03           1.750000D-04
                  3.598080D+02           1.057000D-03
                  1.440580D+01           1.690000D-01
                  9.076320D+00          -4.217930D-01
                  2.088100D+00           6.388640D-01
                  1.034980D+00           3.201150D-01
                  3.162840D-01          -8.144280D-01
                  1.217190D-01          -4.897980D-01
            S    1   1.00
                  3.162840D-01           1.000000D+00
            S    1   1.00
                  1.217190D-01           1.000000D+00
            S    1   1.00
                  4.200000D-02           1.0000000
            P    6   1.00
                  1.953010D+01           5.893400D-02
                  1.108820D+01          -2.309300D-01
                  2.715630D+00           6.648010D-01
                  1.204300D+00           4.506730D-01
                  3.399450D-01           2.898000D-02
                  1.108810D-01          -2.889000D-03
            P    6   1.00
                  1.953010D+01          -1.883600D-02
                  1.108820D+01           8.000600D-02
                  2.715630D+00          -3.066520D-01
                  1.204300D+00          -1.475940D-01
                  3.399450D-01           6.075060D-01
                  1.108810D-01           5.470490D-01
            P    1   1.00
                  1.108810D-01           1.000000D+00
            P    1   1.00
                  3.380000D-02           1.0000000
            D    6   1.00
                  4.547650D+01           4.266000D-03
                  1.319280D+01          -1.362500D-02
                  4.227410D+00           3.097560D-01
                  1.942800D+00           5.097720D-01
                  8.397710D-01           2.974610D-01
                  3.000000D-01           4.016400D-02
            D    1   1.00
                  3.000000D-01           1.000000D+00
            D    1   1.00
                  1.191000D-01           1.0000000
            ****
            -Xe     0
            S    8   1.00
               2058.3200000              0.0009380
                307.4270000              0.0044200
                 15.7815000              0.3543950
                  9.5447000             -0.8885140
                  2.2296900              0.9496240
                  1.1120000              0.3810660
                  0.3554300              0.0125430
                  0.1377260             -0.0010730
            S    8   1.00
               2058.3200000             -0.0004380
                307.4270000             -0.0022770
                 15.7815000             -0.1557960
                  9.5447000              0.4175780
                  2.2296900             -0.6793250
                  1.1120000             -0.3183090
                  0.3554300              0.8356730
                  0.1377260              0.4854110
            S    1   1.00
                  0.3554300              1.0000000
            S    1   1.00
                  0.1377260              1.0000000
            S    1   1.00
                  0.0473000              1.0000000
            P    6   1.00
                 20.1725000              0.0687400
                 11.8122000             -0.2446140
                  2.9346000              0.6676480
                  1.3189000              0.4501800
                  0.3858160              0.0286890
                  0.1269610             -0.0034820
            P    6   1.00
                 20.1725000             -0.0229670
                 11.8122000              0.0881150
                  2.9346000             -0.3233110
                  1.3189000             -0.1542280
                  0.3858160              0.6228820
                  0.1269610              0.5375650
            P    1   1.00
                  0.1269610              1.0000000
            P    1   1.00
                  0.0379000              1.0000000
            D    6   1.00
                 52.6666000              0.0048070
                 14.3464000             -0.0045170
                  4.8159700              0.3015100
                  2.2149600              0.5120370
                  0.9611280              0.2990900
                  0.3412000              0.0395700
            D    1   1.00
                  0.3412000              1.0000000
            D    1   1.00
                  0.1404000              1.0000000
            ****
            -Hf     0
            S    7   1.00
                 29.2650000              0.0294330
                 18.3491000             -0.1987340
                 11.5257000              0.4359330
                  4.3859900             -0.7730970
                  0.8910800              0.8677580
                  0.4057400              0.4202920
                  0.0950670              0.0131930
            S    7   1.00
                 29.2650000             -0.0090770
                 18.3491000              0.0611920
                 11.5257000             -0.1354740
                  4.3859900              0.2530470
                  0.8910800             -0.3699320
                  0.4057400             -0.3314430
                  0.0950670              0.6577990
            S    7   1.00
                 29.2650000              0.0309420
                 18.3491000             -0.1631770
                 11.5257000              0.3100050
                  4.3859900             -0.5289420
                  0.8910800              1.2562440
                  0.4057400             -0.4970260
                  0.0950670             -1.8102840
            S    1   1.00
                  0.0358680              1.0000000
            S    1   1.00
                  0.0135000              1.0000000
            P    6   1.00
                  7.1199600              0.1786130
                  4.6018200             -0.5085500
                  2.9004600              0.1812060
                  0.9377910              0.6364370
                  0.3915000              0.4348840
                  0.1071520              0.0442170
            P    6   1.00
                  7.1199600             -0.0485910
                  4.6018200              0.1398590
                  2.9004600             -0.0462230
                  0.9377910             -0.2282940
                  0.3915000             -0.1575630
                  0.1071520              0.5288190
            P    6   1.00
                  7.1199600             -0.0658780
                  4.6018200              0.1871460
                  2.9004600             -0.0488380
                  0.9377910             -0.3615180
                  0.3915000             -0.1743340
                  0.1071520              0.9190410
            P    1   1.00
                  0.0367710              1.0000000
            P    1   1.00
                  0.0126000              1.0000000
            D    5   1.00
                  7.4982700              0.0144910
                  4.6961800             -0.0529680
                  1.0636000              0.2380440
                  0.4188210              0.4352750
                  0.1545660              0.4244200
            D    5   1.00
                  7.4982700             -0.0165460
                  4.6961800              0.0618730
                  1.0636000             -0.3167410
                  0.4188210             -0.5274120
                  0.1545660              0.3428660
            D    1   1.00
                  0.0526440              1.0000000
            D    1   1.00
                  0.0179000              1.0000000
            F    1   1.00
                  0.2700000              1.0000000
            F    1   1.00
                  0.0824000              1.0000000
            ****
            -Ta     0
            S    7   1.00
                 29.8670000              0.0287250
                 18.7203000             -0.1985810
                 11.7533000              0.4482880
                  4.5708900             -0.7983960
                  0.9478400              0.8861040
                  0.4340380              0.4136940
                  0.1050310              0.0121460
            S    7   1.00
                 29.8670000             -0.0091320
                 18.7203000              0.0630170
                 11.7533000             -0.1437480
                  4.5708900              0.2705360
                  0.9478400             -0.4015970
                  0.4340380             -0.3195670
                  0.1050310              0.6651050
            S    7   1.00
                 29.8670000              0.0324720
                 18.7203000             -0.1723550
                 11.7533000              0.3341840
                  4.5708900             -0.5725580
                  0.9478400              1.3652610
                  0.4340380             -0.6032250
                  0.1050310             -1.7315730
            S    1   1.00
                  0.0389480              1.0000000
            S    1   1.00
                  0.0144000              1.0000000
            P    6   1.00
                  7.3652400              0.1796820
                  4.7544000             -0.5211000
                  2.9959500              0.1911040
                  0.9941230              0.6464550
                  0.4196000              0.4240400
                  0.1182390              0.0425600
            P    6   1.00
                  7.3652400             -0.0508780
                  4.7544000              0.1495500
                  2.9959500             -0.0507540
                  0.9941230             -0.2483790
                  0.4196000             -0.1478010
                  0.1182390              0.5415390
            P    6   1.00
                  7.3652400             -0.0697670
                  4.7544000              0.2016550
                  2.9959500             -0.0482900
                  0.9941230             -0.4247200
                  0.4196000             -0.1275720
                  0.1182390              0.9415430
            P    1   1.00
                  0.0401010              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  7.5616000              0.0178690
                  4.7408700             -0.0661360
                  1.1697500              0.2554580
                  0.4793100              0.4454920
                  0.1837040              0.4029670
            D    5   1.00
                  7.5616000             -0.0205840
                  4.7408700              0.0780240
                  1.1697500             -0.3544000
                  0.4793100             -0.5155940
                  0.1837040              0.4207610
            D    1   1.00
                  0.0644090              1.0000000
            D    1   1.00
                  0.0226000              1.0000000
            F    1   1.00
                  0.3735000              1.0000000
            F    1   1.00
                  0.1286000              1.0000000
            ****
            -W     0
            S    7   1.00
                 31.1844000              0.0268990
                 19.5385000             -0.1892380
                 12.2602000              0.4339650
                  4.7203700             -0.8043720
                  1.0095700              0.9015400
                  0.4634560              0.4101950
                  0.1137920              0.0110440
            S    7   1.00
                 31.1844000             -0.0086330
                 19.5385000              0.0609770
                 12.2602000             -0.1418640
                  4.7203700              0.2797320
                  1.0095700             -0.4285050
                  0.4634560             -0.3050150
                  0.1137920              0.6713040
            S    7   1.00
                 31.1844000              0.0314780
                 19.5385000             -0.1676990
                 12.2602000              0.3282920
                  4.7203700             -0.5865250
                  1.0095700              1.4154490
                  0.4634560             -0.6488270
                  0.1137920             -1.6892530
            S    1   1.00
                  0.0416420              1.0000000
            S    1   1.00
                  0.0152000              1.0000000
            P    6   1.00
                  7.7873800              0.1852090
                  5.0493000             -0.5283120
                  3.1860200              0.1871580
                  1.0593700              0.6560130
                  0.4491060              0.4179250
                  0.1276250              0.0409650
            P    6   1.00
                  7.7873800             -0.0535080
                  5.0493000              0.1546790
                  3.1860200             -0.0504270
                  1.0593700             -0.2604500
                  0.4491060             -0.1384050
                  0.1276250              0.5459010
            P    6   1.00
                  7.7873800             -0.0749390
                  5.0493000              0.2120220
                  3.1860200             -0.0424460
                  1.0593700             -0.4793750
                  0.4491060             -0.0766750
                  0.1276250              0.9477960
            P    1   1.00
                  0.0427440              1.0000000
            P    1   1.00
                  0.0143000              1.0000000
            D    5   1.00
                  8.3098300              0.0219490
                  5.2246300             -0.0773760
                  1.2952900              0.2632410
                  0.5397610              0.4595460
                  0.2089270              0.3922120
            D    5   1.00
                  8.3098300             -0.0263810
                  5.2246300              0.0952520
                  1.2952900             -0.3960520
                  0.5397610             -0.5079960
                  0.2089270              0.5236000
            D    1   1.00
                  0.0731130              1.0000000
            D    1   1.00
                  0.0256000              1.0000000
            F    1   1.00
                  0.4769000              1.0000000
            F    1   1.00
                  0.1768000              1.0000000
            ****
            -Re     0
            S    7   1.00
                 33.0133000              0.0221330
                 20.6658000             -0.1618310
                 12.9498000              0.3812300
                  4.7782300             -0.7875220
                  1.0858000              0.8980810
                  0.5000250              0.4224690
                  0.1210690              0.0172060
            S    7   1.00
                 33.0133000             -0.0070680
                 20.6658000              0.0530520
                 12.9498000             -0.1282310
                  4.7782300              0.2853960
                  1.0858000             -0.4487810
                  0.5000250             -0.2976680
                  0.1210690              0.6634730
            S    7   1.00
                 33.0133000              0.0274240
                 20.6658000             -0.1468310
                 12.9498000              0.2908580
                  4.7782300             -0.5801000
                  1.0858000              1.4204980
                  0.5000250             -0.6321790
                  0.1210690             -1.6875030
            S    1   1.00
                  0.0438810              1.0000000
            S    1   1.00
                  0.0159000              1.0000000
            P    6   1.00
                  8.6759800              0.1394900
                  5.6538200             -0.3569770
                  1.4063900              0.4818040
                  0.6920560              0.5117960
                  0.3163520              0.1708180
                  0.1093090              0.0097820
            P    6   1.00
                  8.6759800             -0.0412390
                  5.6538200              0.1083450
                  1.4063900             -0.1688840
                  0.6920560             -0.2386860
                  0.3163520              0.0632430
                  0.1093090              0.6102210
            P    6   1.00
                  8.6759800             -0.0651350
                  5.6538200              0.1725300
                  1.4063900             -0.2649320
                  0.6920560             -0.4743410
                  0.3163520              0.3991830
                  0.1093090              0.8030920
            P    1   1.00
                  0.0385810              1.0000000
            P    1   1.00
                  0.0136000              1.0000000
            D    5   1.00
                  8.6719700              0.0171910
                  5.4414200             -0.0665390
                  1.3750800              0.2711570
                  0.5838300              0.4487710
                  0.2293620              0.3778590
            D    5   1.00
                  8.6719700             -0.0203340
                  5.4414200              0.0775390
                  1.3750800             -0.3686920
                  0.5838300             -0.4745880
                  0.2293620              0.4599950
            D    1   1.00
                  0.0808850              1.0000000
            D    1   1.00
                  0.0285000              1.0000000
            F    1   1.00
                  0.5533000              1.0000000
            F    1   1.00
                  0.2126000              1.0000000
            ****
            -Os     0
            S    7   1.00
                 34.5933000              0.0194050
                 21.6442000             -0.1468750
                 13.5521000              0.3551890
                  4.8950800             -0.7883690
                  1.1634600              0.9033000
                  0.5380840              0.4302560
                  0.1306730              0.0181640
            S    7   1.00
                 34.5933000             -0.0059240
                 21.6442000              0.0475810
                 13.5521000             -0.1198590
                  4.8950800              0.2905900
                  1.1634600             -0.4633260
                  0.5380840             -0.2910580
                  0.1306730              0.6489970
            S    7   1.00
                 34.5933000              0.0286790
                 21.6442000             -0.1533520
                 13.5521000              0.3066570
                  4.8950800             -0.6590400
                  1.1634600              1.6880660
                  0.5380840             -0.9098660
                  0.1306730             -1.5178370
            S    1   1.00
                  0.0469820              1.0000000
            S    1   1.00
                  0.0169000              1.0000000
            P    6   1.00
                  9.1259400              0.1316100
                  5.8907300             -0.3487910
                  1.4397800              0.5276330
                  0.6929760              0.5000040
                  0.3084380              0.1387070
                  0.1086800              0.0055910
            P    6   1.00
                  9.1259400             -0.0379630
                  5.8907300              0.1036120
                  1.4397800             -0.1857190
                  0.6929760             -0.2213770
                  0.3084380              0.0960590
                  0.1086800              0.6029380
            P    6   1.00
                  9.1259400             -0.0676070
                  5.8907300              0.1858450
                  1.4397800             -0.3480470
                  0.6929760             -0.4511480
                  0.3084380              0.5586130
                  0.1086800              0.7068530
            P    1   1.00
                  0.0381830              1.0000000
            P    1   1.00
                  0.0134000              1.0000000
            D    5   1.00
                  9.3395000              0.0158420
                  5.8557100             -0.0635100
                  1.4647600              0.2828700
                  0.6312200              0.4507810
                  0.2506620              0.3664550
            D    5   1.00
                  9.3395000             -0.0209240
                  5.8557100              0.0807150
                  1.4647600             -0.4242800
                  0.6312200             -0.4620180
                  0.2506620              0.5555660
            D    1   1.00
                  0.0891640              1.0000000
            D    1   1.00
                  0.0317000              1.0000000
            F    1   1.00
                  0.6278000              1.0000000
            F    1   1.00
                  0.2478000              1.0000000
            ****
            -Ir     0
            S    7   1.00
                 36.0577000              0.0172890
                 22.5516000             -0.1359910
                 14.1116000              0.3386690
                  5.0447500             -0.7941690
                  1.2441700              0.9080010
                  0.5769240              0.4378070
                  0.1394660              0.0187690
            S    7   1.00
                 36.0577000             -0.0049480
                 22.5516000              0.0431240
                 14.1116000             -0.1138030
                  5.0447500              0.2953180
                  1.2441700             -0.4732180
                  0.5769240             -0.2840000
                  0.1394660              0.6351880
            S    7   1.00
                 36.0577000              0.0290550
                 22.5516000             -0.1546790
                 14.1116000              0.3116730
                  5.0447500             -0.7039290
                  1.2441700              1.8161160
                  0.5769240             -1.0291110
                  0.1394660             -1.4393180
            S    1   1.00
                  0.0497400              1.0000000
            S    1   1.00
                  0.0177000              1.0000000
            P    6   1.00
                  9.5858000              0.1256510
                  6.1408800             -0.3433060
                  1.4976000              0.5536780
                  0.7141440              0.4910420
                  0.3120660              0.1228370
                  0.1151600              0.0033780
            P    6   1.00
                  9.5858000             -0.0379390
                  6.1408800              0.1069870
                  1.4976000             -0.2083670
                  0.7141440             -0.2217720
                  0.3120660              0.1266520
                  0.1151600              0.6103680
            P    6   1.00
                  9.5858000             -0.0740030
                  6.1408800              0.2101790
                  1.4976000             -0.4612670
                  0.7141440             -0.3768670
                  0.3120660              0.6521120
                  0.1151600              0.6073860
            P    1   1.00
                  0.0412770              1.0000000
            P    1   1.00
                  0.0148000              1.0000000
            D    5   1.00
                  9.9606900              0.0154630
                  6.2430300             -0.0631200
                  1.5631700              0.2923090
                  0.6819400              0.4527480
                  0.2734460              0.3571590
            D    5   1.00
                  9.9606900             -0.0198010
                  6.2430300              0.0777020
                  1.5631700             -0.4252400
                  0.6819400             -0.4331870
                  0.2734460              0.4752470
            D    1   1.00
                  0.0980080              1.0000000
            D    1   1.00
                  0.0351000              1.0000000
            F    1   1.00
                  0.7127000              1.0000000
            F    1   1.00
                  0.2898000              1.0000000
            ****
            -Pt     0
            S    7   1.00
                 37.3750000              0.0156980
                 23.3685000             -0.1285150
                 14.6164000              0.3299960
                  5.2209620             -0.8039770
                  1.3267320              0.9127650
                  0.6163210              0.4444260
                  0.1480680              0.0192250
            S    7   1.00
                 37.3750000             -0.0041400
                 23.3685000              0.0396870
                 14.6164000             -0.1100630
                  5.2209620              0.3003960
                  1.3267320             -0.4809750
                  0.6163210             -0.2769970
                  0.1480680              0.6216130
            S    7   1.00
                 37.3750000              0.0303040
                 23.3685000             -0.1595530
                 14.6164000              0.3222870
                  5.2209620             -0.7469090
                  1.3267320              1.9183060
                  0.6163210             -1.1164460
                  0.1480680             -1.3836520
            S    1   1.00
                  0.0523910              1.0000000
            S    1   1.00
                  0.0185000              1.0000000
            P    6   1.00
                  9.9926800              0.1240460
                  6.3831700             -0.3446320
                  1.5696500              0.5711200
                  0.7427790              0.4873560
                  0.3180200              0.1119590
                  0.1141460              0.0019280
            P    6   1.00
                  9.9926800             -0.0346870
                  6.3831700              0.0999320
                  1.5696500             -0.2018840
                  0.7427790             -0.1984590
                  0.3180200              0.1230340
                  0.1141460              0.5955770
            P    6   1.00
                  9.9926800             -0.0771530
                  6.3831700              0.2234940
                  1.5696500             -0.5228040
                  0.7427790             -0.3298980
                  0.3180200              0.7297730
                  0.1141460              0.5372880
            P    1   1.00
                  0.0398630              1.0000000
            P    1   1.00
                  0.0139000              1.0000000
            D    5   1.00
                 10.4126000              0.0150800
                  6.5226600             -0.0622950
                  1.6643000              0.3006490
                  0.7342080              0.4539610
                  0.2974070              0.3490010
            D    5   1.00
                 10.4126000             -0.0198660
                  6.5226600              0.0796630
                  1.6643000             -0.4687940
                  0.7342080             -0.4051740
                  0.2974070              0.5192890
            D    1   1.00
                  0.1075990              1.0000000
            D    1   1.00
                  0.0389000              1.0000000
            F    1   1.00
                  0.8018000              1.0000000
            F    1   1.00
                  0.3357000              1.0000000
            ****
            -Au     0
            S    8   1.00
                 38.0008000              0.0200090
                 23.9725000             -0.1516790
                 15.2182000              0.3639600
                  5.5399900             -0.8213260
                  1.3855100              0.9366410
                  0.6424610              0.4235270
                  0.1564960              0.0162500
                  0.0549100             -0.0009780
            S    8   1.00
                 38.0008000             -0.0053040
                 23.9725000              0.0463180
                 15.2182000             -0.1199400
                  5.5399900              0.3040620
                  1.3855100             -0.4945010
                  0.6424610             -0.2555160
                  0.1564960              0.6091630
                  0.0549100              0.5977670
            S    8   1.00
                 38.0008000              0.0323400
                 23.9725000             -0.1717620
                 15.2182000              0.3395030
                  5.5399900             -0.7461790
                  1.3855100              1.9174980
                  0.6424610             -1.1299310
                  0.1564960             -1.3662840
                  0.0549100              1.4423910
            S    1   1.00
                  0.0549100              1.0000000
            S    1   1.00
                  0.0193000              1.0000000
            P    7   1.00
                 10.3092000              0.1282170
                  6.6276500             -0.3537900
                  1.6744700              0.5662110
                  0.8011160              0.4931710
                  0.3468790              0.1137750
                  0.1227010              0.0025340
                  0.0424280              0.0006790
            P    7   1.00
                 10.3092000             -0.0358850
                  6.6276500              0.1028900
                  1.6744700             -0.2009880
                  0.8011160             -0.2010450
                  0.3468790              0.1165490
                  0.1227010              0.5949690
                  0.0424280              0.4555200
            P    7   1.00
                 10.3092000             -0.0772420
                  6.6276500              0.2226110
                  1.6744700             -0.4953530
                  0.8011160             -0.3607470
                  0.3468790              0.7100000
                  0.1227010              0.5688390
                  0.0424280              0.0011930
            P    1   1.00
                  0.0424280              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.0027000              0.0164670
                  6.8916600             -0.0680130
                  1.8080800              0.2994920
                  0.8210510              0.4543030
                  0.3441610              0.3442240
                  0.1297430              0.1212560
            D    6   1.00
                 11.0027000             -0.0236280
                  6.8916600              0.0956720
                  1.8080800             -0.5412940
                  0.8210510             -0.3955330
                  0.3441610              0.6191650
                  0.1297430              0.4682760
            D    1   1.00
                  0.1297430              1.0000000
            D    1   1.00
                  0.0489000              1.0000000
            F    1   1.00
                  0.8919000              1.0000000
            F    1   1.00
                  0.3789000              1.0000000
            ****
            -Hg     0
            S    8   1.00
                 41.4804000              0.0100720
                 22.5328000             -0.1147810
                 14.0790000              0.3564080
                  5.7247400             -0.8484430
                  1.4794800              0.9405960
                  0.6882660              0.4353290
                  0.1641810              0.0131780
                  0.0572230             -0.0023140
            S    8   1.00
                 41.4804000              0.0020320
                 22.5328000             -0.0323140
                 14.0790000              0.1153500
                  5.7247400             -0.3177630
                  1.4794800              0.5135230
                  0.6882660              0.2500500
                  0.1641810             -0.6488410
                  0.0572230             -0.5599430
            S    8   1.00
                 41.4804000              0.0218280
                 22.5328000             -0.1555640
                 14.0790000              0.3860250
                  5.7247400             -0.8961040
                  1.4794800              2.3321950
                  0.6882660             -1.5976600
                  0.1641810             -1.0536460
                  0.0572230              1.2895360
            S    1   1.00
                  0.0572230              1.0000000
            S    1   1.00
                  0.0199000              1.0000000
            P    7   1.00
                 10.5805000              0.1286920
                  6.8053900             -0.3608420
                  1.7901600              0.5641170
                  0.8622610              0.5002740
                  0.3752770              0.1137850
                  0.1284210              0.0029390
                  0.0434470              0.0004880
            P    7   1.00
                 10.5805000             -0.0344430
                  6.8053900              0.1009290
                  1.7901600             -0.1924390
                  0.8622610             -0.1960690
                  0.3752770              0.1042040
                  0.1284210              0.5873870
                  0.0434470              0.4727830
            P    7   1.00
                 10.5805000              0.0714680
                  6.8053900             -0.2108590
                  1.7901600              0.4452040
                  0.8622610              0.3916080
                  0.3752770             -0.6670830
                  0.1284210             -0.6195740
                  0.0434470             -0.0009090
            P    1   1.00
                  0.0434470              1.0000000
            P    1   1.00
                  0.0147000              1.0000000
            D    6   1.00
                 11.5841000              0.0167290
                  7.2487900             -0.0695580
                  1.9366200              0.3034370
                  0.8987480              0.4548780
                  0.3869310              0.3368080
                  0.1504660              0.1130160
            D    6   1.00
                 11.5841000             -0.0249840
                  7.2487900              0.1041030
                  1.9366200             -0.6169860
                  0.8987480             -0.3538260
                  0.3869310              0.6872800
                  0.1504660              0.3930900
            D    1   1.00
                  0.1504660              1.0000000
            D    1   1.00
                  0.0585000              1.0000000
            F    1   1.00
                  0.9974000              1.0000000
            F    1   1.00
                  0.4377000              1.0000000
            ****
            -Tl     0
            S    8   1.00
                 36.1096000              0.0229790
                 22.5732000             -0.1728970
                 14.1144000              0.4807030
                  6.1597600             -0.9532140
                  1.5706900              0.9608670
                  0.7459610              0.4319720
                  0.1958840              0.0131990
                  0.0710030             -0.0021060
            S    8   1.00
                 36.1096000              0.0059010
                 22.5732000             -0.0544410
                 14.1144000              0.1709120
                  6.1597600             -0.3868060
                  1.5706900              0.5717530
                  0.7459610              0.2895580
                  0.1958840             -0.7163850
                  0.0710030             -0.5289600
            S    1   1.00
                  0.1958840              1.0000000
            S    1   1.00
                  0.0710030              1.0000000
            S    1   1.00
                  0.0206000              1.0000000
            P    6   1.00
                 10.3856000              0.1621170
                  7.0093900             -0.4046950
                  1.7768800              0.6949780
                  0.7479420              0.4664960
                  0.1768080              0.0280130
                  0.0515320             -0.0041730
            P    6   1.00
                 10.3856000             -0.0391990
                  7.0093900              0.1017260
                  1.7768800             -0.2199420
                  0.7479420             -0.1194500
                  0.1768080              0.4597680
                  0.0515320              0.6763890
            P    1   1.00
                  0.0515320              1.0000000
            P    1   1.00
                  0.0130000              1.0000000
            D    6   1.00
                 10.9087000              0.0217120
                  6.8364900             -0.0832690
                  1.9974900              0.3418070
                  0.9144720              0.4833160
                  0.3895180              0.3047550
                  0.1501000              0.0649830
            D    1   1.00
                  0.1501000              1.0000000
            D    1   1.00
                  0.0437000              1.0000000
            ****
            -Pb     0
            S    8   1.00
                 37.4583000              0.0248240
                 23.3170000             -0.1810620
                 14.5759000              0.5007060
                  6.4337600             -0.9797370
                  1.6671900              0.9666300
                  0.8077320              0.4364870
                  0.2270840              0.0136860
                  0.0842520             -0.0020210
            S    8   1.00
                 37.4583000              0.0067850
                 23.3170000             -0.0601870
                 14.5759000              0.1889710
                  6.4337600             -0.4248380
                  1.6671900              0.6220350
                  0.8077320              0.3160880
                  0.2270840             -0.7594740
                  0.0842520             -0.5151310
            S    1   1.00
                  0.2270840              1.0000000
            S    1   1.00
                  0.0842520              1.0000000
            S    1   1.00
                  0.0278000              1.0000000
            P    6   1.00
                 10.6186000              0.1701740
                  7.1878100             -0.4241790
                  1.8943900              0.6934430
                  0.8167090              0.4737730
                  0.2036880              0.0290470
                  0.0649730             -0.0043860
            P    6   1.00
                 10.6186000             -0.0479540
                  7.1878100              0.1245560
                  1.8943900             -0.2597760
                  0.8167090             -0.1414800
                  0.2036880              0.5317690
                  0.0649730              0.6087590
            P    1   1.00
                  0.0649730              1.0000000
            P    1   1.00
                  0.0197000              1.0000000
            D    6   1.00
                 13.7266000              0.0107870
                  6.9898300             -0.0666500
                  2.1735200              0.3342590
                  1.0281200              0.4826840
                  0.4558570              0.3004140
                  0.1822000              0.0632580
            D    1   1.00
                  0.1822000              1.0000000
            D    1   1.00
                  0.0609000              1.0000000
            ****
            -Bi     0
            S    8   1.00
                211.8210000              0.0010880
                 21.3262000             -0.1058620
                 13.3654000              0.5308080
                  6.9461000             -1.0502650
                  1.7122900              0.9958560
                  0.8391070              0.3989520
                  0.2553640              0.0117780
                  0.0967000             -0.0014700
            S    8   1.00
                211.8210000              0.0004220
                 21.3262000             -0.0385370
                 13.3654000              0.2172380
                  6.9461000             -0.4810970
                  1.7122900              0.7015950
                  0.8391070              0.2905200
                  0.2553640             -0.7997780
                  0.0967000             -0.4961310
            S    1   1.00
                  0.2553640              1.0000000
            S    1   1.00
                  0.0967000              1.0000000
            S    1   1.00
                  0.0317000              1.0000000
            P    6   1.00
                 11.0644000              0.1672490
                  7.4500000             -0.4252620
                  2.0106900              0.6925250
                  0.8883210              0.4753740
                  0.2363690              0.0298590
                  0.0792900             -0.0044930
            P    6   1.00
                 11.0644000             -0.0522010
                  7.4500000              0.1390830
                  2.0106900             -0.2935560
                  0.8883210             -0.1585740
                  0.2363690              0.5743620
                  0.0792900              0.5726780
            P    1   1.00
                  0.0792900              1.0000000
            P    1   1.00
                  0.0254000              1.0000000
            D    6   1.00
                 16.2461000              0.0078080
                  6.9836300             -0.0668310
                  2.3747600              0.3241400
                  1.1537200              0.4858310
                  0.5259740              0.3010560
                  0.2151000              0.0631960
            D    1   1.00
                  0.2151000              1.0000000
            D    1   1.00
                  0.0745000              1.0000000
            ****
            -Po     0
            S    8   1.00
                295.3900000              0.0013830
                 21.2683000             -0.1050610
                 13.3379000              0.5914250
                  7.3652100             -1.1156970
                  1.7892000              1.0191620
                  0.8849940              0.3798790
                  0.2857870              0.0107810
                  0.1093240             -0.0011440
            S    8   1.00
                295.3900000              0.0006830
                 21.2683000             -0.0385730
                 13.3379000              0.2519580
                  7.3652100             -0.5330160
                  1.7892000              0.7669010
                  0.8849940              0.2818780
                  0.2857870             -0.8394770
                  0.1093240             -0.4792720
            S    1   1.00
                  0.2857870              1.0000000
            S    1   1.00
                  0.1093240              1.0000000
            S    1   1.00
                  0.0359000              1.0000000
            P    6   1.00
                 11.5069000              0.1663640
                  7.7299100             -0.4272350
                  2.1189400              0.6969640
                  0.9553230              0.4713590
                  0.2683520              0.0299870
                  0.0884940             -0.0034870
            P    6   1.00
                 11.5069000             -0.0559100
                  7.7299100              0.1511230
                  2.1189400             -0.3261600
                  0.9553230             -0.1614090
                  0.2683520              0.6016150
                  0.0884940              0.5559720
            P    1   1.00
                  0.0884940              1.0000000
            P    1   1.00
                  0.0278000              1.0000000
            D    6   1.00
                 18.7130000              0.0066940
                  7.0570800             -0.0671040
                  2.5506200              0.3257980
                  1.2506900              0.4957630
                  0.5742560              0.2931060
                  0.2330000              0.0541620
            D    1   1.00
                  0.2330000              1.0000000
            D    1   1.00
                  0.0895000              1.0000000
            ****
            -At     0
            S    8   1.00
                304.0310000              0.0010310
                 22.4085000             -0.1018690
                 14.0490000              0.5632730
                  7.5895000             -1.1045120
                  1.8949400              1.0263640
                  0.9523580              0.3833240
                  0.3170410              0.0113590
                  0.1224900             -0.0011400
            S    8   1.00
                304.0310000              0.0004960
                 22.4085000             -0.0387430
                 14.0490000              0.2490070
                  7.5895000             -0.5516910
                  1.8949400              0.8155580
                  0.9523580              0.2868020
                  0.3170410             -0.8682780
                  0.1224900             -0.4694960
            S    1   1.00
                  0.3170410              1.0000000
            S    1   1.00
                  0.1224900              1.0000000
            S    1   1.00
                  0.0404000              1.0000000
            P    6   1.00
                 12.0093000              0.1631810
                  8.0330000             -0.4244130
                  2.2239300              0.7031340
                  1.0213300              0.4641680
                  0.3012660              0.0302600
                  0.0999030             -0.0026180
            P    6   1.00
                 12.0093000             -0.0583630
                  8.0330000              0.1606310
                  2.2239300             -0.3589420
                  1.0213300             -0.1621230
                  0.3012660              0.6248880
                  0.0999030              0.5397840
            P    1   1.00
                  0.0999030              1.0000000
            P    1   1.00
                  0.0313000              1.0000000
            D    6   1.00
                 21.3084000              0.0061410
                  7.0207600             -0.0706690
                  2.7689800              0.3190200
                  1.3731400              0.5044700
                  0.6368040              0.2924810
                  0.2593000              0.0514950
            D    1   1.00
                  0.2593000              1.0000000
            D    1   1.00
                  0.1073000              1.0000000
            ****
            -Rn     0
            S    8   1.00
                383.5850000              0.0015720
                 23.2936000             -0.0761810
                 14.6096000              0.4785080
                  7.7319900             -1.0439020
                  1.9942400              1.0190710
                  1.0240700              0.3914520
                  0.3454220              0.0127820
                  0.1350810             -0.0012970
            S    8   1.00
                383.5850000              0.0009020
                 23.2936000             -0.0265350
                 14.6096000              0.2148510
                  7.7319900             -0.5453780
                  1.9942400              0.8694020
                  1.0240700              0.2728620
                  0.3454220             -0.8929670
                  0.1350810             -0.4539150
            S    1   1.00
                  0.3454220              1.0000000
            S    1   1.00
                  0.1350810              1.0000000
            S    1   1.00
                  0.0449000              1.0000000
            P    6   1.00
                 12.4992000              0.1629940
                  8.3397600             -0.4262290
                  2.3359100              0.7107760
                  1.0901900              0.4580860
                  0.3348980              0.0292130
                  0.1125460             -0.0031070
            P    6   1.00
                 12.4992000             -0.0609340
                  8.3397600              0.1694830
                  2.3359100             -0.3880550
                  1.0901900             -0.1612760
                  0.3348980              0.6446740
                  0.1125460              0.5255260
            P    1   1.00
                  0.1125460              1.0000000
            P    1   1.00
                  0.0348000              1.0000000
            D    6   1.00
                 24.1705000              0.0058780
                  6.9459900             -0.0765200
                  3.0380900              0.3071660
                  1.5168400              0.5141680
                  0.7091570              0.2972850
                  0.2888000              0.0512000
            D    1   1.00
                  0.2888000              1.0000000
            D    1   1.00
                  0.1251000              1.0000000
            ****
            
            -Y     0
            Y-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      7.85827500           135.13497400
            2      3.38212800            15.41163200
            p-g potential
              4
            2      6.84979100            29.25143700
            2      6.71009200            58.50836300
            2      3.04215900             3.78024300
            2      2.93733000             7.67654700
            d-g potential
              4
            2      5.41631500            11.84991100
            2      5.33341600            17.77810300
            2      1.97621200             2.06238300
            2      1.96111100             3.07565000
            f-g potential
              2
            2      5.02859000            -6.92807800
            2      5.00558200            -9.15509900
            -ZR     0
            ZR-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      8.63652800           150.24299400
            2      3.71763900            18.78003600
            p-g potential
              4
            2      7.62672800            33.19279100
            2      7.45320700            66.38903900
            2      3.35838900             4.62072600
            2      3.22973800             9.26027000
            d-g potential
              4
            2      5.93808600            13.99338300
            2      5.82554400            20.99588200
            2      2.20501900             2.28516600
            2      2.20629200             3.44126000
            f-g potential
              2
            2      4.80021500            -5.23932000
            2      4.79899200            -6.98742400
            -NB     0
            NB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2      9.37657800           165.15673600
            2      4.04357200            21.82395100
            p-g potential
              4
            2      8.36360900            37.24928400
            2      8.16689800            74.50738900
            2      3.69307500             5.43948600
            2      3.55104700            10.91325200
            d-g potential
              4
            2      6.68910800            15.21454900
            2      6.53719300            22.83350800
            2      2.55111800             3.00005200
            2      2.56789600             4.55373400
            f-g potential
              2
            2      5.56828500            -6.28135400
            2      5.67137200            -8.75564400
            -MO     0
            MO-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.09700000           180.07685300
            2      4.37567000            24.71592000
            p-g potential
              4
            2      9.12656400            41.22767800
            2      8.86322300            82.45267000
            2      4.04494800             6.34509200
            2      3.86665700            12.45842300
            d-g potential
              4
            2      7.53575400            19.30874400
            2      7.27897600            28.97767400
            2      2.76320500             3.18951600
            2      2.77208500             4.70016900
            f-g potential
              2
            2      6.30663300            -7.17888800
            2      6.35644800            -9.74597800
            -TC     0
            TC-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     10.79936900           195.09130300
            2      4.70725700            27.34041300
            p-g potential
              4
            2      9.82669900            45.06081200
            2      9.56111500            90.11729500
            2      4.37857800             7.07051700
            2      4.19090700            14.04801900
            d-g potential
              4
            2      8.33604500            21.65775500
            2      8.24453300            32.47195900
            2      3.09370700             3.78952500
            2      3.16872200             6.05343000
            f-g potential
              2
            2      7.04094000            -7.99562300
            2      7.06947300           -10.74569600
            -RU     0
            RU-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     11.50059000           209.78649300
            2      5.06857500            30.21430700
            p-g potential
              4
            2     10.53263400            48.75124400
            2     10.19201000            97.49652900
            2      4.73489200             7.86018800
            2      4.50906500            15.32975100
            d-g potential
              4
            2      8.87797700            26.96750600
            2      8.76612200            40.43230300
            2      3.17019600             3.34075800
            2      3.22885100             5.25635200
            f-g potential
              2
            2      7.82024900            -8.84752500
            2      7.83964700           -11.83551800
            -RH     0
            RH-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.19481600           225.31205400
            2      5.40513700            32.44158200
            p-g potential
              4
            2     11.28075500            52.87282600
            2     10.92724800           105.74552600
            2      5.09011700             8.61934400
            2      4.85183200            16.97345900
            d-g potential
              4
            2      9.13633700            25.10850100
            2      8.96480800            37.69573100
            2      3.64361200             4.20258400
            2      3.63600700             6.29279000
            f-g potential
              2
            2      8.61622800            -9.67356800
            2      8.62943500           -12.89984700
            -PD     0
            PD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.79882500           240.26278900
            2      5.80052800            34.72996100
            p-g potential
              4
            2     11.87469700            56.74692900
            2     11.47433500           113.44441700
            2      5.51599900             9.34563900
            2      5.24804300            18.34544700
            d-g potential
              4
            2      8.50221200            28.59555400
            2      7.98332400            43.45392100
            2      3.10762800             1.85228600
            2      2.47673400             1.40676500
            f-g potential
              2
            2      9.67957100           -10.98725500
            2      9.69134900           -14.62619000
            -AG     0
            AG-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     12.5677140            255.0547710
            2      6.9976620             36.9833930
            p-g potential
              4
            2     11.3164960             60.7157050
            2     10.9580630            121.4438890
            2      7.1114000             10.1718660
            2      6.7733190             20.4865640
            d-g potential
              4
            2      8.9284370             29.5049380
            2     11.1025670             44.0187360
            2      5.5432120              5.3683330
            2      3.9288350              7.4083750
            f-g potential
              2
            2     11.0129130            -12.6234030
            2     11.0198980            -16.7643270
            -CD     0
            CD-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     13.3551760            270.0394480
            2      7.3083780             38.8777660
            p-g potential
              4
            2     12.6597280             64.6074700
            2     12.2896390            129.2194450
            2      6.7861760             10.6225580
            2      6.4007430             21.2650460
            d-g potential
              4
            2     11.1617220             31.6639650
            2     11.2196150             47.4892160
            2      4.5377330              5.1862000
            2      4.3357270              7.5660630
            f-g potential
              2
            2     11.4789860            -12.6327850
            2     11.4870270            -16.7601710
            -IN     0
            IN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     15.3928220            281.1223500
            2      8.0558640             61.9014700
            p-g potential
              4
            2     13.9286720             67.4621540
            2     13.3472340            134.9492500
            2      7.6141320             14.7461400
            2      7.3183650             29.6392620
            d-g potential
              4
            2     14.0347150             35.4932540
            2     14.5116160             53.1787730
            2      5.5505500              9.1772810
            2      5.0594150             12.3924100
            f-g potential
              2
            2     12.5390560            -13.7280780
            2     12.5525610            -18.2068660
            -SN     0
            SN-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     17.4204140            279.9886820
            2      7.6311550             62.3778100
            p-g potential
              4
            2     16.1310240             66.1625230
            2     15.6280770            132.1743960
            2      7.3256080             16.3394170
            2      6.9425190             32.4889590
            d-g potential
              4
            2     15.5149760             36.3874410
            2     15.1881600             54.5078410
            2      5.4560240              8.6968230
            2      5.3631050             12.8402080
            f-g potential
              2
            2     12.2823480            -12.5763330
            2     12.2721500            -16.5959440
            -SB     0
            SB-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.3308650            281.0715810
            2      8.5565420             61.7166040
            p-g potential
              4
            2     14.4703370             67.4573800
            2     13.8161940            134.9335030
            2      8.4249240             14.7163440
            2      8.0927280             29.5185120
            d-g potential
              4
            2     14.8863310             35.4478150
            2     15.1463190             53.1434660
            2      5.9082670              9.1792230
            2      5.5943220             13.2402530
            f-g potential
              2
            2     14.4449780            -15.3668010
            2     14.4492950            -20.2961380
            -TE     0
            TE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              2
            2     16.8144730            281.0458430
            2      8.7935260             61.6206560
            p-g potential
              4
            2     14.8778010             67.4494640
            2     14.2697310            134.9043040
            2      8.7244350             14.6895470
            2      8.2915150             29.4150630
            d-g potential
              4
            2     15.2050080             35.4320570
            2     15.2258480             53.1356870
            2      6.0717690              9.0698020
            2      5.8047600             13.1223040
            f-g potential
              2
            2     15.2061680            -15.7454500
            2     15.2017020            -20.7424480
            -I     0
            I-ECP     4     28
            g potential
              1
            2      1.00000000             0.00000000
            s-g potential
              3
            2     40.03337600            49.98964900
            2     17.30057600           281.00655600
            2      8.85172000            61.41673900
            p-g potential
              4
            2     15.72014100            67.41623900
            2     15.20822200           134.80769600
            2      8.29418600            14.56654800
            2      7.75394900            28.96842200
            d-g potential
              4
            2     13.81775100            35.53875600
            2     13.58780500            53.33975900
            2      6.94763000             9.71646600
            2      6.96009900            14.97750000
            f-g potential
              4
            2     18.52295000           -20.17661800
            2     18.25103500           -26.08807700
            2      7.55790100            -0.22043400
            2      7.59740400            -0.22164600
            -XE     0
            XE-ECP     4     28
            g potential
              1
            2      1.0000000              0.0000000
            s-g potential
              3
            2     40.0051840             49.9979620
            2     17.8122140            281.0133030
            2      9.3041500             61.5382550
            p-g potential
              4
            2     15.7017720             67.4391420
            2     15.2586080            134.8747110
            2      9.2921840             14.6633000
            2      8.5590030             29.3547300
            d-g potential
              6
            2     15.1856000             35.4369080
            2     14.2845000             53.1957720
            2      7.1218890              9.0462320
            2      6.9919630             13.2236810
            2      0.6239460              0.0848530
            2      0.6472840              0.0441550
            f-g potential
              4
            2     20.8815570            -23.0892950
            2     20.7834430            -30.0744750
            2      5.2533890             -0.2882270
            2      5.3611880             -0.3869240
            -HF     0
            HF-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.24885600           478.23740400
            4     10.72912700             0.38802400
            2      1.96485600            -1.07123200
            p-h potential
              6
            2      8.68346200           101.04681800
            2      7.91692000           212.19776100
            4      9.37924300             0.13264600
            4      8.24420900             0.45310800
            2      1.59668600            -0.40791400
            2      1.71028100            -0.56181700
            d-h potential
              6
            2      5.18955700            43.11546700
            2      5.25322900            65.93473200
            4      5.93787100             0.02591200
            4      5.71290600             0.03374100
            2      1.01485600            -0.28057900
            2      0.47371200            -0.08484900
            f-h potential
              2
            2      1.91260800             4.81180100
            2      1.88074000             6.41857400
            g-h potential
              2
            2      2.72418000            -4.63658500
            2      2.70895300            -5.76728800
            -TA     0
            TA-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              3
            2     10.31806900           454.60064900
            4     10.54026700             2.83797500
            2      2.57472600            -0.81473600
            p-h potential
              6
            2      8.74334200            96.91078300
            2      7.91622300           195.85043200
            4      9.27573600             4.81252400
            4      8.10167500             6.33851200
            2      2.07712700            -0.45917300
            2      2.75037200            -0.64458600
            d-h potential
              6
            2      5.44731400            45.96997600
            2      5.21254500            69.63897200
            4      5.88435800             0.80293300
            4      5.64957900             0.42959500
            2      1.38818000            -0.30722700
            2      1.29439800            -0.46156000
            f-h potential
              2
            2      2.16127500             5.75777300
            2      2.12593900             7.67816700
            g-h potential
              2
            2      3.14592000            -5.68406600
            2      3.12794200            -7.06231300
            -W     0
            W-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     11.06379500           419.22759900
            2      8.21764100            41.19130700
            p-h potential
              6
            2      9.33818800           107.34811000
            2      8.43044800           214.69956800
            4      9.49002000             0.02544200
            4      9.48994700             0.05189500
            2      1.88299700            -0.11718400
            2      1.90697200             0.29668900
            d-h potential
              6
            2      6.20543300            58.88127900
            2      6.12215700            98.68355600
            4      6.27455600             0.01953700
            4      6.22637500             0.02195600
            2      1.96387500            -0.08857700
            2      1.88828700            -0.20972600
            f-h potential
              2
            2      2.30795300             6.23247200
            2      2.27060900             8.31134500
            g-h potential
              2
            2      3.58349100            -6.80294400
            2      3.56251500            -8.44323200
            -RE     0
            RE-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     12.16381400           421.97030000
            2      7.10759500            50.13443900
            p-h potential
              4
            2      9.68459700            88.48191000
            2      9.47621400           176.78722000
            2      7.66806600            10.43433800
            2      5.05515600            20.45874300
            d-h potential
              4
            2      6.50988800            43.16243100
            2      6.09121600            64.76775900
            2      4.16400600             5.34030100
            2      4.40737900             8.24333200
            f-h potential
              2
            2      2.56265800             7.24454300
            2      2.52154900             9.65926600
            g-h potential
              2
            2      4.03459900            -7.97494000
            2      4.00962800            -9.88273600
            -OS     0
            OS-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.00200100           424.39037600
            2      6.96276300            57.12250300
            p-h potential
              4
            2     10.49894100            88.27900300
            2      9.99252300           176.48606400
            2      6.58824800            11.71501200
            2      5.03716700            22.91500600
            d-h potential
              4
            2      7.08344100            44.77770800
            2      6.72117900            67.15364800
            2      3.79462600             5.55038700
            2      3.74812500             8.22010400
            f-h potential
              2
            2      2.82627600             8.32833200
            2      2.78119800            11.10310200
            g-h potential
              2
            2      4.49698100            -9.18134300
            2      4.46773800           -11.36160400
            -IR     0
            IR-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     13.83147400           426.95814900
            2      7.04791400            65.33881300
            p-h potential
              4
            2     11.10643300            88.07544200
            2     10.45655200           176.12477000
            2      6.37961400            12.68226000
            2      5.06472600            24.63594900
            d-h potential
              4
            2      7.54875400            46.43325800
            2      7.26530800            69.63807400
            2      3.80096900             6.15024800
            2      3.71828000             9.46356000
            f-h potential
              2
            2      3.09870600             9.48361000
            2      3.04946100            12.64274200
            g-h potential
              2
            2      4.96979000           -10.41069700
            2      4.93561400           -12.86319600
            -PT     0
            PT-ECP     5     60
            h potential
              1
            2      1.00000000             0.00000000
            s-h potential
              2
            2     14.60450000           429.64608700
            2      7.21828700            73.15688400
            p-h potential
              4
            2     11.57716200            88.02291700
            2     10.88384300           175.99819600
            2      6.42440300            13.68227400
            2      5.22419800            27.41465100
            d-h potential
              4
            2      7.69961000            43.55785200
            2      7.55080800            65.36910800
            2      3.96116400             7.01859600
            2      3.87277700            11.39173300
            f-h potential
              2
            2      3.37986900            10.71022000
            2      3.32625500            14.27812500
            g-h potential
              2
            2      5.45202000           -11.65174900
            2      5.41258500           -14.37552500
            -AU     0
            AU-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.5232180            426.6418670
            2      6.2643840             36.8006680
            p-h potential
              4
            2     11.4138670             87.0020910
            2     10.3292150            174.0043700
            2      5.7074240              8.8706100
            2      4.8281650             17.9024380
            d-h potential
              4
            2      7.4309630             49.8836550
            2      8.3219900             74.6845490
            2      4.6096420              6.4862270
            2      3.5115070              9.5468210
            f-h potential
              2
            2      3.0846390              8.7916400
            2      3.0247430             11.6584560
            g-h potential
              2
            2      3.9784420             -5.2343370
            2      4.0114910             -6.7381420
            -HG     0
            HG-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.4130710            275.7747970
            2      6.8979130             49.2678980
            p-h potential
              4
            2     11.3103200             80.5069840
            2     10.2107730            161.0348240
            2      5.9398040              9.0834160
            2      5.0197550             18.3677730
            d-h potential
              4
            2      8.4078950             51.1372560
            2      8.2140860             76.7074590
            2      4.0126120              6.5618210
            2      3.7953980              9.8180700
            f-h potential
              2
            2      3.2731060              9.4290010
            2      3.2083210             12.4948560
            g-h potential
              2
            2      4.4852960             -6.3384140
            2      4.5132000             -8.0998630
            -TL     0
            TL-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.1678050            281.2846630
            2      8.2949090             62.4342510
            p-h potential
              4
            2      7.1514920              4.6334080
            2      5.1728650              9.3417560
            2      9.8910720             72.2992530
            2      9.0033910            144.5580370
            d-h potential
              4
            2      7.1302180             35.9430390
            2      6.9269060             53.9095930
            2      5.4175700             10.3819390
            2      5.1386810             15.5838220
            f-h potential
              4
            2      5.6263990             15.8254880
            2      5.5489520             21.1040210
            2      2.8749460              2.9151270
            2      2.8214510              3.8969030
            g-h potential
              4
            2      6.6790570             -7.4945340
            2      6.7068350             -9.5405750
            2      7.2092840             -7.7979920
            2      7.0709640             -9.2595240
            -PB     0
            PB-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     12.2963030            281.2854990
            2      8.6326340             62.5202170
            p-h potential
              4
            2     10.2417900             72.2768970
            2      8.9241760            144.5910830
            2      6.5813420              4.7586930
            2      6.2554030              9.9406210
            d-h potential
              4
            2      7.7543360             35.8485070
            2      7.7202810             53.7243420
            2      4.9702640             10.1152560
            2      4.5637890             14.8337310
            f-h potential
              2
            2      3.8875120             12.2098920
            2      3.8119630             16.1902910
            g-h potential
              2
            2      5.6915770             -9.0966650
            2      5.7155670            -11.5319960
            -BI     0
            BI-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.0430900            283.2642270
            2      8.2216820             62.4719590
            p-h potential
              4
            2     10.4677770             72.0014990
            2      9.1189010            144.0022770
            2      6.7547910              5.0079450
            2      6.2525920              9.9915500
            d-h potential
              4
            2      8.0814740             36.3962590
            2      7.8905950             54.5976640
            2      4.9555560              9.9842940
            2      4.7045590             14.9814850
            f-h potential
              2
            2      4.2145460             13.7133830
            2      4.1334000             18.1943080
            g-h potential
              2
            2      6.2057090            -10.2474430
            2      6.2277820            -12.9557100
            -PO     0
            PO-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              2
            2     13.2772270            283.2447060
            2      8.3995180             62.3964610
            p-h potential
              4
            2     10.6656820             71.9917160
            2      9.2837530            143.9718710
            2      6.8727490              4.9496150
            2      6.3261500              9.7404990
            d-h potential
              4
            2      8.2148660             36.3783830
            2      8.0086960             54.5627150
            2      5.0552270              9.8894990
            2      4.7825530             14.6938770
            f-h potential
              4
            2      5.0132700             17.4282950
            2      4.9846400             23.3803530
            2      1.3267600              0.1633920
            2      1.5287580              0.3245660
            g-h potential
              2
            2      6.7715260            -11.5632940
            2      6.7779250            -14.5097880
            -AT     0
            AT-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.2008320             49.9571580
            2     13.6123060            283.2103710
            2      8.5293400             62.2810520
            p-h potential
              4
            2     10.8540650             71.9823710
            2      9.4682290            143.9035320
            2      7.0311140              4.8717590
            2      6.1438580              8.9830590
            d-h potential
              4
            2      8.3135150             36.3632370
            2      7.9989650             54.5489700
            2      5.1799660              9.7762850
            2      4.9422260             14.2647550
            f-h potential
              4
            2      5.8121630             19.8701980
            2      5.7537150             26.4164520
            2      2.5134720              0.9949700
            2      2.5362610              1.4907010
            g-h potential
              4
            2      9.8957780            -22.2232030
            2      9.7373340            -26.7154760
            2      3.0133310             -0.3730440
            2      3.0977630             -0.4859460
            -RN     0
            RN-ECP     5     60
            h potential
              1
            2      1.0000000              0.0000000
            s-h potential
              3
            2     30.1512420             49.9655510
            2     14.5212410            283.0700000
            2      8.0520380             62.0028700
            p-h potential
              4
            2     11.0099420             71.9691190
            2      9.6176250            143.8605590
            2      7.3360080              4.7147610
            2      6.4062530              9.0130650
            d-h potential
              4
            2      8.3692200             36.3683650
            2      8.1169750             54.5517610
            2      5.3536560              9.6344870
            2      5.0972120             14.3879020
            f-h potential
              4
            2      6.3485710             21.7972900
            2      6.2959490             28.9468050
            2      2.8821180              1.4473650
            2      2.9080480              2.1779640
            g-h potential
              4
            2     11.0152050            -25.2280950
            2     10.9098530            -30.5661210
            2      3.4827610             -0.5748000
            2      3.6004180             -0.7795380
            
 Initial command:
 /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe "/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/Tuned_LCPBE/23_tartaric_acid_300_STD/Gau-20440.inp" -scrdir="/projects/academic/jochena/pierpa/VROA36_Benchmark/VROA_532/Experimental_Lasers/Tuned_LCPBE/23_tartaric_acid_300_STD/"
 Entering Link 1 = /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1.exe PID=     20443.
  
 Copyright (c) 1988,1990,1992,1993,1995,1998,2003,2009,2016,
            Gaussian, Inc.  All Rights Reserved.
  
 This is part of the Gaussian(R) 16 program.  It is based on
 the Gaussian(R) 09 system (copyright 2009, Gaussian, Inc.),
 the Gaussian(R) 03 system (copyright 2003, Gaussian, Inc.),
 the Gaussian(R) 98 system (copyright 1998, Gaussian, Inc.),
 the Gaussian(R) 94 system (copyright 1995, Gaussian, Inc.),
 the Gaussian 92(TM) system (copyright 1992, Gaussian, Inc.),
 the Gaussian 90(TM) system (copyright 1990, Gaussian, Inc.),
 the Gaussian 88(TM) system (copyright 1988, Gaussian, Inc.),
 the Gaussian 86(TM) system (copyright 1986, Carnegie Mellon
 University), and the Gaussian 82(TM) system (copyright 1983,
 Carnegie Mellon University). Gaussian is a federally registered
 trademark of Gaussian, Inc.
  
 This software contains proprietary and confidential information,
 including trade secrets, belonging to Gaussian, Inc.
  
 This software is provided under written license and may be
 used, copied, transmitted, or stored only in accord with that
 written license.
  
 The following legend is applicable only to US Government
 contracts under FAR:
  
                    RESTRICTED RIGHTS LEGEND
  
 Use, reproduction and disclosure by the US Government is
 subject to restrictions as set forth in subparagraphs (a)
 and (c) of the Commercial Computer Software - Restricted
 Rights clause in FAR 52.227-19.
  
 Gaussian, Inc.
 340 Quinnipiac St., Bldg. 40, Wallingford CT 06492
  
  
 ---------------------------------------------------------------
 Warning -- This program may not be used in any manner that
 competes with the business of Gaussian, Inc. or will provide
 assistance to any competitor of Gaussian, Inc.  The licensee
 of this program is prohibited from giving any competitor of
 Gaussian, Inc. access to this program.  By using this program,
 the user acknowledges that Gaussian, Inc. is engaged in the
 business of creating and licensing software in the field of
 computational chemistry and represents and warrants to the
 licensee that it is not a competitor of Gaussian, Inc. and that
 it will not use this program in any manner prohibited above.
 ---------------------------------------------------------------
  

 Cite this work as:
 Gaussian 16, Revision A.03,
 M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, 
 M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, 
 G. A. Petersson, H. Nakatsuji, X. Li, M. Caricato, A. V. Marenich, 
 J. Bloino, B. G. Janesko, R. Gomperts, B. Mennucci, H. P. Hratchian, 
 J. V. Ortiz, A. F. Izmaylov, J. L. Sonnenberg, D. Williams-Young, 
 F. Ding, F. Lipparini, F. Egidi, J. Goings, B. Peng, A. Petrone, 
 T. Henderson, D. Ranasinghe, V. G. Zakrzewski, J. Gao, N. Rega, 
 G. Zheng, W. Liang, M. Hada, M. Ehara, K. Toyota, R. Fukuda, 
 J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, 
 T. Vreven, K. Throssell, J. A. Montgomery, Jr., J. E. Peralta, 
 F. Ogliaro, M. J. Bearpark, J. J. Heyd, E. N. Brothers, K. N. Kudin, 
 V. N. Staroverov, T. A. Keith, R. Kobayashi, J. Normand, 
 K. Raghavachari, A. P. Rendell, J. C. Burant, S. S. Iyengar, 
 J. Tomasi, M. Cossi, J. M. Millam, M. Klene, C. Adamo, R. Cammi, 
 J. W. Ochterski, R. L. Martin, K. Morokuma, O. Farkas, 
 J. B. Foresman, and D. J. Fox, Gaussian, Inc., Wallingford CT, 2016.
 
 ******************************************
 Gaussian 16:  ES64L-G16RevA.03 25-Dec-2016
                28-Jul-2021 
 ******************************************
 %NoSave
 %nproc=8
 Will use up to    8 processors via shared memory.
 %mem=42GB
 %chk=23_tartaric_acid_300_STD_LCPBE_augccpVDZ
 ----------------------------------------------------------------------
 #P SP LC-PBEPBE/Gen Integral=UltraFineGrid SCF=(NoSymm,MaxCyc=120,Tigh
 t) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq IOp(1/33=1,3/107=037300
 0000,3/108=0373000000,3/119=1000000000,3/120=1000000000,3/130=-1,3/131
 =-1)
 ----------------------------------------------------------------------
 1/29=2,33=1,38=1,83=21,172=1/1;
 2/12=2,40=1/2;
 3/5=7,11=2,14=-4,25=1,30=1,36=2,74=1001009,75=-5,107=373000000,108=373000000,116=-2,119=1000000000,120=1000000000,130=-1,131=-1/1,2,3;
 4/5=1,9=2/1;
 5/5=2,7=120,32=2,38=6,98=1/2;
 8/6=4,10=90,11=11/1;
 10/13=10,49=112,72=3/2;
 6/7=2,8=2,9=2,10=2,28=1/1;
 7/8=1,25=21/16;
 99/5=1/99;
 Leave Link    1 at Wed Jul 28 19:15:44 2021, MaxMem=  5637144576 cpu:               1.3 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l101.exe)
 ONIOM results not found on unit 2.
 -----------------
 ROA calculations.
 -----------------
 TstMul:  ICh=     0
 TstMul:  Mul=     1
 TstMul:  ICh=     0
 TstMul:  Mul=     1
 Structure from the checkpoint file:  "23_tartaric_acid_300_STD_LCPBE_augccpVDZ.chk"
 Charge =  0 Multiplicity = 1
 No Z-Matrix found in chk file; cartesian coordinates used.
  C                                                -1.464416000000     -0.510638000000     -0.301760000000
  O                                                -1.226068000000     -1.649988000000     -0.632869000000
  O                                                -2.372478000000      0.237815000000     -0.908297000000
  C                                                -0.752797000000      0.166934000000      0.877420000000
  C                                                 0.752808000000     -0.166909000000      0.877405000000
  C                                                 1.464382000000      0.510618000000     -0.301784000000
  O                                                 1.226101000000      1.650002000000     -0.632837000000
  O                                                -1.004751000000      1.555168000000      0.901145000000
  O                                                 1.004808000000     -1.555150000000      0.901196000000
  O                                                 2.372410000000     -0.237840000000     -0.908359000000
  H                                                -1.183171000000     -0.268641000000      1.783396000000
  H                                                 1.183171000000      0.268677000000      1.783379000000
  H                                                 2.347339000000     -1.116286000000     -0.478105000000
  H                                                -2.347390000000      1.116250000000     -0.478019000000
  H                                                -0.303553000000      1.976048000000      0.360817000000
  H                                                 0.303578000000     -1.976155000000      0.361020000000
 Recover connectivity data from disk.
 After GenITR:
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 ITRead=  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0  0
 MicOpt= -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1 -1
 NAtoms=     16 NQM=       16 NQMF=       0 NMMI=      0 NMMIF=      0
                NMic=       0 NMicF=      0.
                    Isotopes and Nuclear Properties:
 (Nuclear quadrupole moments (NQMom) in fm**2, nuclear magnetic moments (NMagM)
  in nuclear magnetons)

  Atom         1           2           3           4           5           6           7           8           9          10
 IAtWgt=          12          16          16          12          12          12          16          16          16          16
 AtmWgt=  12.0000000  15.9949146  15.9949146  12.0000000  12.0000000  12.0000000  15.9949146  15.9949146  15.9949146  15.9949146
 NucSpn=           0           0           0           0           0           0           0           0           0           0
 AtZEff=   3.6000000   5.6000000   5.6000000   3.6000000   3.6000000   3.6000000   5.6000000   5.6000000   5.6000000   5.6000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 AtZNuc=   6.0000000   8.0000000   8.0000000   6.0000000   6.0000000   6.0000000   8.0000000   8.0000000   8.0000000   8.0000000

  Atom        11          12          13          14          15          16
 IAtWgt=           1           1           1           1           1           1
 AtmWgt=   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250   1.0078250
 NucSpn=           1           1           1           1           1           1
 AtZEff=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 NQMom=    0.0000000   0.0000000   0.0000000   0.0000000   0.0000000   0.0000000
 NMagM=    2.7928460   2.7928460   2.7928460   2.7928460   2.7928460   2.7928460
 AtZNuc=   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000   1.0000000
 No MM parameters found.
 Using perturbation frequencies:    0.088559
 Leave Link  101 at Wed Jul 28 19:15:45 2021, MaxMem=  5637144576 cpu:               1.0 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l202.exe)
                          Input orientation:                          
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0       -1.464416   -0.510638   -0.301760
      2          8           0       -1.226068   -1.649988   -0.632869
      3          8           0       -2.372478    0.237815   -0.908297
      4          6           0       -0.752797    0.166934    0.877420
      5          6           0        0.752808   -0.166909    0.877405
      6          6           0        1.464382    0.510618   -0.301784
      7          8           0        1.226101    1.650002   -0.632837
      8          8           0       -1.004751    1.555168    0.901145
      9          8           0        1.004808   -1.555150    0.901196
     10          8           0        2.372410   -0.237840   -0.908359
     11          1           0       -1.183171   -0.268641    1.783396
     12          1           0        1.183171    0.268677    1.783379
     13          1           0        2.347339   -1.116286   -0.478105
     14          1           0       -2.347390    1.116250   -0.478019
     15          1           0       -0.303553    1.976048    0.360817
     16          1           0        0.303578   -1.976155    0.361020
 ---------------------------------------------------------------------
                    Distance matrix (angstroms):
                    1          2          3          4          5
     1  C    0.000000
     2  O    1.210191   0.000000
     3  O    1.323875   2.225740   0.000000
     4  C    1.534917   2.409598   2.411882   0.000000
     5  C    2.534692   2.897654   3.622147   1.542173   0.000000
     6  C    3.101745   3.466462   3.894069   2.534664   1.534883
     7  O    3.466534   4.111334   3.875554   2.897655   2.409565
     8  O    2.434302   3.560225   2.623009   1.411112   2.460717
     9  O    2.938567   2.709088   4.230254   2.460755   1.411128
    10  O    3.894049   3.875448   4.768670   3.622122   2.411865
    11  H    2.117909   2.783576   2.985994   1.093499   2.139903
    12  H    3.459025   3.914583   4.459676   2.139880   1.093497
    13  H    3.863597   3.616356   4.929029   3.618694   2.298098
    14  H    1.859429   2.988882   0.978477   2.298074   3.618687
    15  H    2.823158   3.871251   2.985390   1.934320   2.444387
    16  H    2.390151   1.853110   3.697851   2.444469   1.934382
                    6          7          8          9         10
     6  C    0.000000
     7  O    1.210194   0.000000
     8  O    2.938493   2.709021   0.000000
     9  O    2.434290   3.560229   3.703027   0.000000
    10  O    1.323872   2.225732   4.230177   2.623000   0.000000
    11  H    3.459011   3.914584   2.033834   2.687124   4.459669
    12  H    2.117905   2.783523   2.687080   2.033815   2.986018
    13  H    1.859440   2.988890   4.502833   1.974199   0.978476
    14  H    3.863606   3.616448   1.974189   4.502871   4.929023
    15  H    2.390004   1.852969   0.980190   3.804363   3.697687
    16  H    2.823263   3.871410   3.804432   0.980183   2.985486
                   11         12         13         14         15
    11  H    0.000000
    12  H    2.426579   0.000000
    13  H    4.277545   2.896156   0.000000
    14  H    2.896088   4.277518   5.198528   0.000000
    15  H    2.799301   2.673789   4.158551   2.370689   0.000000
    16  H    2.673795   2.799296   2.370752   4.158676   3.998564
                   16
    16  H    0.000000
 Stoichiometry    C4H6O6
 Framework group  C1[X(C4H6O6)]
 Deg. of freedom    42
 Full point group                 C1      NOp   1
 RotChk:  IX=0 Diff= 3.93D-17
 Largest Abelian subgroup         C1      NOp   1
 Largest concise Abelian subgroup C1      NOp   1
                         Standard orientation:                         
 ---------------------------------------------------------------------
 Center     Atomic      Atomic             Coordinates (Angstroms)
 Number     Number       Type             X           Y           Z
 ---------------------------------------------------------------------
      1          6           0       -1.464416   -0.510638   -0.301760
      2          8           0       -1.226068   -1.649988   -0.632869
      3          8           0       -2.372478    0.237815   -0.908297
      4          6           0       -0.752797    0.166934    0.877420
      5          6           0        0.752808   -0.166909    0.877405
      6          6           0        1.464382    0.510618   -0.301784
      7          8           0        1.226101    1.650002   -0.632837
      8          8           0       -1.004751    1.555168    0.901145
      9          8           0        1.004808   -1.555150    0.901196
     10          8           0        2.372410   -0.237840   -0.908359
     11          1           0       -1.183171   -0.268641    1.783396
     12          1           0        1.183171    0.268677    1.783379
     13          1           0        2.347339   -1.116286   -0.478105
     14          1           0       -2.347390    1.116250   -0.478019
     15          1           0       -0.303553    1.976048    0.360817
     16          1           0        0.303578   -1.976155    0.361020
 ---------------------------------------------------------------------
 Rotational constants (GHZ):           1.8283046           1.1678491           0.9656679
 Leave Link  202 at Wed Jul 28 19:15:45 2021, MaxMem=  5637144576 cpu:               0.7 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l301.exe)
 General basis read from cards:  (5D, 7F)
 Centers:      11     12     13     14     15     16
 S 4 1.00
     Exponent=  1.3010000000D+01 Coefficients=  1.9685000000D-02
     Exponent=  1.9620000000D+00 Coefficients=  1.3797700000D-01
     Exponent=  4.4460000000D-01 Coefficients=  4.7814800000D-01
     Exponent=  1.2200000000D-01 Coefficients=  5.0124000000D-01
 S 1 1.00
     Exponent=  1.2200000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  2.9740000000D-02 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  7.2700000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  1.4100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       1      4      5      6
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients=  6.9200000000D-04
     Exponent=  1.0000000000D+03 Coefficients=  5.3290000000D-03
     Exponent=  2.2800000000D+02 Coefficients=  2.7077000000D-02
     Exponent=  6.4710000000D+01 Coefficients=  1.0171800000D-01
     Exponent=  2.1060000000D+01 Coefficients=  2.7474000000D-01
     Exponent=  7.4950000000D+00 Coefficients=  4.4856400000D-01
     Exponent=  2.7970000000D+00 Coefficients=  2.8507400000D-01
     Exponent=  5.2150000000D-01 Coefficients=  1.5204000000D-02
     Exponent=  1.5960000000D-01 Coefficients= -3.1910000000D-03
 S 9 1.00
     Exponent=  6.6650000000D+03 Coefficients= -1.4600000000D-04
     Exponent=  1.0000000000D+03 Coefficients= -1.1540000000D-03
     Exponent=  2.2800000000D+02 Coefficients= -5.7250000000D-03
     Exponent=  6.4710000000D+01 Coefficients= -2.3312000000D-02
     Exponent=  2.1060000000D+01 Coefficients= -6.3955000000D-02
     Exponent=  7.4950000000D+00 Coefficients= -1.4998100000D-01
     Exponent=  2.7970000000D+00 Coefficients= -1.2726200000D-01
     Exponent=  5.2150000000D-01 Coefficients=  5.4452900000D-01
     Exponent=  1.5960000000D-01 Coefficients=  5.8049600000D-01
 S 1 1.00
     Exponent=  1.5960000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  4.6900000000D-02 Coefficients=  1.0000000000D+00
 P 4 1.00
     Exponent=  9.4390000000D+00 Coefficients=  3.8109000000D-02
     Exponent=  2.0020000000D+00 Coefficients=  2.0948000000D-01
     Exponent=  5.4560000000D-01 Coefficients=  5.0855700000D-01
     Exponent=  1.5170000000D-01 Coefficients=  4.6884200000D-01
 P 1 1.00
     Exponent=  1.5170000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  4.0410000000D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  5.5000000000D-01 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.5100000000D-01 Coefficients=  1.0000000000D+00
 ****
 Centers:       2      3      7      8      9     10
 S 9 1.00
     Exponent=  1.1720000000D+04 Coefficients=  7.1000000000D-04
     Exponent=  1.7590000000D+03 Coefficients=  5.4700000000D-03
     Exponent=  4.0080000000D+02 Coefficients=  2.7837000000D-02
     Exponent=  1.1370000000D+02 Coefficients=  1.0480000000D-01
     Exponent=  3.7030000000D+01 Coefficients=  2.8306200000D-01
     Exponent=  1.3270000000D+01 Coefficients=  4.4871900000D-01
     Exponent=  5.0250000000D+00 Coefficients=  2.7095200000D-01
     Exponent=  1.0130000000D+00 Coefficients=  1.5458000000D-02
     Exponent=  3.0230000000D-01 Coefficients= -2.5850000000D-03
 S 9 1.00
     Exponent=  1.1720000000D+04 Coefficients= -1.6000000000D-04
     Exponent=  1.7590000000D+03 Coefficients= -1.2630000000D-03
     Exponent=  4.0080000000D+02 Coefficients= -6.2670000000D-03
     Exponent=  1.1370000000D+02 Coefficients= -2.5716000000D-02
     Exponent=  3.7030000000D+01 Coefficients= -7.0924000000D-02
     Exponent=  1.3270000000D+01 Coefficients= -1.6541100000D-01
     Exponent=  5.0250000000D+00 Coefficients= -1.1695500000D-01
     Exponent=  1.0130000000D+00 Coefficients=  5.5736800000D-01
     Exponent=  3.0230000000D-01 Coefficients=  5.7275900000D-01
 S 1 1.00
     Exponent=  3.0230000000D-01 Coefficients=  1.0000000000D+00
 S 1 1.00
     Exponent=  7.8960000000D-02 Coefficients=  1.0000000000D+00
 P 4 1.00
     Exponent=  1.7700000000D+01 Coefficients=  4.3018000000D-02
     Exponent=  3.8540000000D+00 Coefficients=  2.2891300000D-01
     Exponent=  1.0460000000D+00 Coefficients=  5.0872800000D-01
     Exponent=  2.7530000000D-01 Coefficients=  4.6053100000D-01
 P 1 1.00
     Exponent=  2.7530000000D-01 Coefficients=  1.0000000000D+00
 P 1 1.00
     Exponent=  6.8560000000D-02 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  1.1850000000D+00 Coefficients=  1.0000000000D+00
 D 1 1.00
     Exponent=  3.3200000000D-01 Coefficients=  1.0000000000D+00
 ****
 Ernie: Thresh=  0.10000D-02 Tol=  0.10000D-05 Strict=F.
 Ernie:  30 primitive shells out of 328 were deleted.
 There are   304 symmetry adapted cartesian basis functions of A   symmetry.
 There are   284 symmetry adapted basis functions of A   symmetry.
   284 basis functions,   542 primitive gaussians,   304 cartesian basis functions
    39 alpha electrons       39 beta electrons
       nuclear repulsion energy       591.3890664853 Hartrees.
 IExCor=11009 DFT=T Ex=LC-PBE+HF Corr=PBE ExCW=0 ScaHFX=  1.000000
 ScaDFX=  1.000000  1.000000  1.000000  1.000000 ScalE2=  1.000000  1.000000
 IRadAn=      5 IRanWt=     -1 IRanGd=            0 ICorTp=0 IEmpDi=  4
 HFx  wShort=  0.000000 wLong=  0.373000 cFull=  0.000000 cShort=  0.000000 cLong=  1.000000
 DFx  wShort=  0.000000 wLong=  0.373000 cFull=  0.000000 cShort=  0.000000 cLong=  1.000000
 NAtoms=   16 NActive=   16 NUniq=   16 SFac= 1.00D+00 NAtFMM=   60 NAOKFM=F Big=F
 Integral buffers will be    131072 words long.
 Raffenetti 2 integral format.
 Two-electron integral symmetry is turned on.
 Leave Link  301 at Wed Jul 28 19:15:49 2021, MaxMem=  5637144576 cpu:              23.7 elap:               3.5
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l302.exe)
 NPDir=0 NMtPBC=     1 NCelOv=     1 NCel=       1 NClECP=     1 NCelD=      1
         NCelK=      1 NCelE2=     1 NClLst=     1 CellRange=     0.0.
 One-electron integrals computed using PRISM.
 One-electron integral symmetry used in STVInt
 NBasis=   284 RedAO= T EigKep=  1.72D-05  NBF=   284
 NBsUse=   284 1.00D-06 EigRej= -1.00D+00 NBFU=   284
 Precomputing XC quadrature grid using
 IXCGrd= 4 IRadAn=           5 IRanWt=          -1 IRanGd=           0 AccXCQ= 0.00D+00.
 Generated NRdTot=       0 NPtTot=           0 NUsed=           0 NTot=          32
 NSgBfM=   304   304   304   304   304 MxSgAt=    16 MxSgA2=    16.
 Leave Link  302 at Wed Jul 28 19:15:50 2021, MaxMem=  5637144576 cpu:               3.8 elap:               0.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l303.exe)
 DipDrv:  MaxL=2.
 Leave Link  303 at Wed Jul 28 19:15:50 2021, MaxMem=  5637144576 cpu:               2.2 elap:               0.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l401.exe)
 Initial guess from the checkpoint file:  "23_tartaric_acid_300_STD_LCPBE_augccpVDZ.chk"
 SCF N**3 symmetry information disabled.
 B after Tr=     0.000000   -0.000000    0.000000
         Rot=    1.000000    0.000000    0.000000    0.000000 Ang=   0.00 deg.
 Guess basis will be translated and rotated to current coordinates.
 JPrj=2 DoOrth=T DoCkMO=T.
 Leave Link  401 at Wed Jul 28 19:15:53 2021, MaxMem=  5637144576 cpu:              15.9 elap:               2.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l502.exe)
 Integral symmetry usage will be decided dynamically.
 Closed shell SCF:
 Using DIIS extrapolation, IDIIS=  1040.
 NGot=  5637144576 LenX=  5636954416 LenY=  5636861559
 Requested convergence on RMS density matrix=1.00D-08 within 120 cycles.
 Requested convergence on MAX density matrix=1.00D-06.
 Requested convergence on             energy=1.00D-06.
 No special actions if energy rises.
 Fock matrices will be formed incrementally for  20 cycles.

 Cycle   1  Pass 1  IDiag  1:
 FoFJK:  IHMeth= 1 ICntrl=       0 DoSepK=T KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=T BraDBF=F KetDBF=F FulRan=T
         wScrn=  0.000000 ICntrl=       500 IOpCl=  0 I1Cent=           0 NGrid=           0
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 E= -605.917765818561    
 DIIS: error= 3.08D-04 at cycle   1 NSaved=   1.
 NSaved= 1 IEnMin= 1 EnMin= -605.917765818561     IErMin= 1 ErrMin= 3.08D-04
 ErrMax= 3.08D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 7.78D-05 BMatP= 7.78D-05
 IDIUse=3 WtCom= 9.97D-01 WtEn= 3.08D-03
 Coeff-Com:  0.100D+01
 Coeff-En:   0.100D+01
 Coeff:      0.100D+01
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=1.82D-04 MaxDP=6.82D-03              OVMax= 2.79D-03

 Cycle   2  Pass 1  IDiag  1:
 RMSU=  1.66D-04    CP:  9.97D-01
 E= -605.917897491741     Delta-E=       -0.000131673180 Rises=F Damp=F
 DIIS: error= 1.80D-04 at cycle   2 NSaved=   2.
 NSaved= 2 IEnMin= 2 EnMin= -605.917897491741     IErMin= 2 ErrMin= 1.80D-04
 ErrMax= 1.80D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.33D-05 BMatP= 7.78D-05
 IDIUse=3 WtCom= 9.98D-01 WtEn= 1.80D-03
 Coeff-Com:  0.165D+00 0.835D+00
 Coeff-En:   0.000D+00 0.100D+01
 Coeff:      0.164D+00 0.836D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=4.59D-05 MaxDP=1.63D-03 DE=-1.32D-04 OVMax= 9.52D-04

 Cycle   3  Pass 1  IDiag  1:
 RMSU=  4.57D-05    CP:  9.97D-01  1.02D+00
 E= -605.917907852602     Delta-E=       -0.000010360862 Rises=F Damp=F
 DIIS: error= 1.15D-04 at cycle   3 NSaved=   3.
 NSaved= 3 IEnMin= 3 EnMin= -605.917907852602     IErMin= 3 ErrMin= 1.15D-04
 ErrMax= 1.15D-04  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.15D-05 BMatP= 2.33D-05
 IDIUse=3 WtCom= 9.99D-01 WtEn= 1.15D-03
 Coeff-Com: -0.117D+00 0.455D+00 0.661D+00
 Coeff-En:   0.000D+00 0.238D+00 0.762D+00
 Coeff:     -0.117D+00 0.455D+00 0.661D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=2.25D-05 MaxDP=8.20D-04 DE=-1.04D-05 OVMax= 6.19D-04

 Cycle   4  Pass 1  IDiag  1:
 RMSU=  1.59D-05    CP:  9.97D-01  1.11D+00  9.24D-01
 E= -605.917917368861     Delta-E=       -0.000009516258 Rises=F Damp=F
 DIIS: error= 1.27D-05 at cycle   4 NSaved=   4.
 NSaved= 4 IEnMin= 4 EnMin= -605.917917368861     IErMin= 4 ErrMin= 1.27D-05
 ErrMax= 1.27D-05  0.00D+00 EMaxC= 1.00D-01 BMatC= 1.60D-07 BMatP= 1.15D-05
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.307D-01 0.778D-01 0.153D+00 0.800D+00
 Coeff:     -0.307D-01 0.778D-01 0.153D+00 0.800D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=3.93D-06 MaxDP=1.49D-04 DE=-9.52D-06 OVMax= 1.91D-04

 Cycle   5  Pass 1  IDiag  1:
 RMSU=  3.04D-06    CP:  9.97D-01  1.11D+00  9.67D-01  1.09D+00
 E= -605.917917513705     Delta-E=       -0.000000144845 Rises=F Damp=F
 DIIS: error= 9.22D-06 at cycle   5 NSaved=   5.
 NSaved= 5 IEnMin= 5 EnMin= -605.917917513705     IErMin= 5 ErrMin= 9.22D-06
 ErrMax= 9.22D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 8.74D-08 BMatP= 1.60D-07
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.595D-02-0.493D-01-0.483D-01 0.449D+00 0.643D+00
 Coeff:      0.595D-02-0.493D-01-0.483D-01 0.449D+00 0.643D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=1.86D-06 MaxDP=6.67D-05 DE=-1.45D-07 OVMax= 6.00D-05

 Cycle   6  Pass 1  IDiag  1:
 RMSU=  1.29D-06    CP:  9.97D-01  1.11D+00  9.84D-01  1.16D+00  9.26D-01
 E= -605.917917586927     Delta-E=       -0.000000073221 Rises=F Damp=F
 DIIS: error= 1.32D-06 at cycle   6 NSaved=   6.
 NSaved= 6 IEnMin= 6 EnMin= -605.917917586927     IErMin= 6 ErrMin= 1.32D-06
 ErrMax= 1.32D-06  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.11D-09 BMatP= 8.74D-08
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.439D-02-0.190D-01-0.265D-01 0.478D-01 0.126D+00 0.868D+00
 Coeff:      0.439D-02-0.190D-01-0.265D-01 0.478D-01 0.126D+00 0.868D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=5.57D-07 MaxDP=1.61D-05 DE=-7.32D-08 OVMax= 2.66D-05

 Cycle   7  Pass 1  IDiag  1:
 RMSU=  4.88D-07    CP:  9.97D-01  1.11D+00  9.88D-01  1.17D+00  9.56D-01
                    CP:  1.08D+00
 E= -605.917917590928     Delta-E=       -0.000000004001 Rises=F Damp=F
 DIIS: error= 6.48D-07 at cycle   7 NSaved=   7.
 NSaved= 7 IEnMin= 7 EnMin= -605.917917590928     IErMin= 7 ErrMin= 6.48D-07
 ErrMax= 6.48D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 4.96D-10 BMatP= 2.11D-09
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.344D-03 0.188D-02-0.756D-03-0.443D-01-0.689D-01 0.263D+00
 Coeff-Com:  0.848D+00
 Coeff:      0.344D-03 0.188D-02-0.756D-03-0.443D-01-0.689D-01 0.263D+00
 Coeff:      0.848D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=2.52D-07 MaxDP=6.34D-06 DE=-4.00D-09 OVMax= 1.00D-05

 Cycle   8  Pass 1  IDiag  1:
 RMSU=  1.54D-07    CP:  9.97D-01  1.11D+00  9.86D-01  1.17D+00  9.85D-01
                    CP:  1.20D+00  1.02D+00
 E= -605.917917591682     Delta-E=       -0.000000000754 Rises=F Damp=F
 DIIS: error= 2.33D-07 at cycle   8 NSaved=   8.
 NSaved= 8 IEnMin= 8 EnMin= -605.917917591682     IErMin= 8 ErrMin= 2.33D-07
 ErrMax= 2.33D-07  0.00D+00 EMaxC= 1.00D-01 BMatC= 2.99D-11 BMatP= 4.96D-10
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.405D-03 0.224D-02 0.230D-02-0.977D-02-0.279D-01-0.403D-01
 Coeff-Com:  0.108D+00 0.966D+00
 Coeff:     -0.405D-03 0.224D-02 0.230D-02-0.977D-02-0.279D-01-0.403D-01
 Coeff:      0.108D+00 0.966D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=8.32D-08 MaxDP=2.11D-06 DE=-7.54D-10 OVMax= 3.94D-06

 Cycle   9  Pass 1  IDiag  1:
 RMSU=  4.91D-08    CP:  9.97D-01  1.11D+00  9.86D-01  1.17D+00  9.86D-01
                    CP:  1.22D+00  1.09D+00  1.18D+00
 E= -605.917917591715     Delta-E=       -0.000000000034 Rises=F Damp=F
 DIIS: error= 7.95D-08 at cycle   9 NSaved=   9.
 NSaved= 9 IEnMin= 9 EnMin= -605.917917591715     IErMin= 9 ErrMin= 7.95D-08
 ErrMax= 7.95D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 5.62D-12 BMatP= 2.99D-11
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com: -0.171D-03 0.697D-03 0.874D-03 0.252D-04-0.580D-02-0.341D-01
 Coeff-Com: -0.327D-01 0.345D+00 0.726D+00
 Coeff:     -0.171D-03 0.697D-03 0.874D-03 0.252D-04-0.580D-02-0.341D-01
 Coeff:     -0.327D-01 0.345D+00 0.726D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=2.22D-08 MaxDP=6.64D-07 DE=-3.37D-11 OVMax= 8.36D-07

 Cycle  10  Pass 1  IDiag  1:
 RMSU=  1.40D-08    CP:  9.97D-01  1.11D+00  9.86D-01  1.17D+00  9.85D-01
                    CP:  1.22D+00  1.10D+00  1.26D+00  1.12D+00
 E= -605.917917591762     Delta-E=       -0.000000000047 Rises=F Damp=F
 DIIS: error= 2.62D-08 at cycle  10 NSaved=  10.
 NSaved=10 IEnMin=10 EnMin= -605.917917591762     IErMin=10 ErrMin= 2.62D-08
 ErrMax= 2.62D-08  0.00D+00 EMaxC= 1.00D-01 BMatC= 8.32D-13 BMatP= 5.62D-12
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.142D-04-0.179D-03-0.145D-03 0.215D-02 0.322D-02-0.306D-02
 Coeff-Com: -0.350D-01-0.664D-01 0.259D+00 0.840D+00
 Coeff:      0.142D-04-0.179D-03-0.145D-03 0.215D-02 0.322D-02-0.306D-02
 Coeff:     -0.350D-01-0.664D-01 0.259D+00 0.840D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=1.03D-08 MaxDP=2.66D-07 DE=-4.68D-11 OVMax= 4.55D-07

 Cycle  11  Pass 1  IDiag  1:
 RMSU=  5.62D-09    CP:  9.97D-01  1.11D+00  9.86D-01  1.17D+00  9.84D-01
                    CP:  1.23D+00  1.10D+00  1.28D+00  1.27D+00  1.08D+00
 E= -605.917917591761     Delta-E=        0.000000000001 Rises=F Damp=F
 DIIS: error= 6.32D-09 at cycle  11 NSaved=  11.
 NSaved=11 IEnMin=10 EnMin= -605.917917591762     IErMin=11 ErrMin= 6.32D-09
 ErrMax= 6.32D-09  0.00D+00 EMaxC= 1.00D-01 BMatC= 3.59D-14 BMatP= 8.32D-13
 IDIUse=1 WtCom= 1.00D+00 WtEn= 0.00D+00
 Coeff-Com:  0.114D-04-0.676D-04-0.795D-04 0.328D-03 0.827D-03 0.205D-02
 Coeff-Com: -0.367D-02-0.332D-01-0.185D-01 0.120D+00 0.933D+00
 Coeff:      0.114D-04-0.676D-04-0.795D-04 0.328D-03 0.827D-03 0.205D-02
 Coeff:     -0.367D-02-0.332D-01-0.185D-01 0.120D+00 0.933D+00
 Gap=     0.430 Goal=   None    Shift=    0.000
 RMSDP=2.91D-09 MaxDP=8.29D-08 DE= 9.09D-13 OVMax= 1.31D-07

 SCF Done:  E(RLC-PBE+HF-PBE) =  -605.917917592     A.U. after   11 cycles
            NFock= 11  Conv=0.29D-08     -V/T= 2.0050
 KE= 6.028772061258D+02 PE=-2.607616870101D+03 EE= 8.074326798976D+02
 Leave Link  502 at Wed Jul 28 19:19:07 2021, MaxMem=  5637144576 cpu:            1545.0 elap:             193.6
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l801.exe)
 DoSCS=F DFT=T ScalE2(SS,OS)=  1.000000  1.000000
 Range of M.O.s used for correlation:     1   284
 NBasis=   284 NAE=    39 NBE=    39 NFC=     0 NFV=     0
 NROrb=    284 NOA=    39 NOB=    39 NVA=   245 NVB=   245

 **** Warning!!: The largest alpha MO coefficient is  0.66735644D+02

 Leave Link  801 at Wed Jul 28 19:19:08 2021, MaxMem=  5637144576 cpu:               0.8 elap:               0.2
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l1002.exe)
 Minotr:  Closed shell wavefunction.
          Direct CPHF calculation.
          Differentiating once with respect to electric field.
                with respect to dipole field.
                with respect to quadrupole field.
          Differentiating once with respect to magnetic field using GIAOs.
          Electric field/nuclear overlap derivatives assumed to be zero.
          Requested convergence is 1.0D-08 RMS, and 1.0D-07 maximum.
          Secondary convergence is 1.0D-12 RMS, and 1.0D-12 maximum.
          NewPWx=F KeepS1=T KeepF1=T KeepIn=T MapXYZ=F SortEE=F KeepMc=T.
         4965 words used for storage of precomputed grid.
 Two-electron integral symmetry used by symmetrizing perturbed Fock matrices.
          MDV=    5637144576 using IRadAn=       1.
          Solving linear equations simultaneously, MaxMat=     384.
          Doing perturbations at frequencies    0.088559
 FoFCou: FMM=F IPFlag=           0 FMFlag=      100000 FMFlg1=           0
         NFxFlg=           0 DoJE=F BraDBF=F KetDBF=T FulRan=T
         wScrn=  0.000000 ICntrl=      6100 IOpCl=  0 I1Cent=           7 NGrid=          16
         NMat0=    1 NMatS0=      1 NMatT0=    0 NMatD0=    1 NMtDS0=    0 NMtDT0=    0
 Symmetry not used in FoFCou.
 FoFJK:  IHMeth= 1 ICntrl=    6127 DoSepK=T KAlg= 0 I1Cent=           0 FoldK=F
 IRaf=         1 NMat=       1 IRICut=       1 DoRegI=T DoRafI=F ISym2E= 0 IDoP0=0 IntGTp=1.
 CalDSu exits because no D1Ps are significant.
          There are    12 degrees of freedom in the 1st order CPHF.  IDoFFX=0 NUNeed=    12.
     11 vectors produced by pass  0 Test12= 1.59D-13 8.33D-09 XBig12= 1.00D+00 2.60D-01.
 AX will form    11 AO Fock derivatives at one time.
     11 vectors produced by pass  1 Test12= 1.59D-13 8.33D-09 XBig12= 2.07D-01 6.92D-02.
     11 vectors produced by pass  2 Test12= 1.59D-13 8.33D-09 XBig12= 3.90D-02 5.04D-02.
     11 vectors produced by pass  3 Test12= 1.59D-13 8.33D-09 XBig12= 3.90D-03 1.60D-02.
     11 vectors produced by pass  4 Test12= 1.59D-13 8.33D-09 XBig12= 5.31D-04 3.91D-03.
     11 vectors produced by pass  5 Test12= 1.59D-13 8.33D-09 XBig12= 3.41D-05 8.49D-04.
     11 vectors produced by pass  6 Test12= 1.59D-13 8.33D-09 XBig12= 8.94D-07 1.27D-04.
     11 vectors produced by pass  7 Test12= 1.59D-13 8.33D-09 XBig12= 2.44D-08 2.25D-05.
     11 vectors produced by pass  8 Test12= 1.59D-13 8.33D-09 XBig12= 8.00D-10 3.50D-06.
     11 vectors produced by pass  9 Test12= 1.59D-13 8.33D-09 XBig12= 2.18D-11 5.24D-07.
      8 vectors produced by pass 10 Test12= 1.59D-13 8.33D-09 XBig12= 4.85D-13 8.95D-08.
      1 vectors produced by pass 11 Test12= 1.59D-13 8.33D-09 XBig12= 1.07D-14 1.24D-08.
 InvSVY:  IOpt=1 It=  1 EMax= 2.13D-14
 Solved reduced A of dimension   119 with    12 vectors.
 FullF1:  Do perturbations      1 to      12.
 SCF Polarizability for W=    0.088559:
                1             2             3 
      1  0.733376D+02
      2 -0.604575D+01  0.775211D+02
      3 -0.235849D-03  0.220631D-03  0.623877D+02
 Isotropic polarizability for W=    0.088559       71.08 Bohr**3.
 Dipole-quadrupole polarizability for W=    0.088559:
                 1             2             3 
      1  -0.432222D-02  0.180311D-02 -0.411275D+02
      2   0.250531D-02 -0.511983D-03 -0.927970D+00
      3   0.181691D-02 -0.129113D-02  0.420554D+02
      4   0.236832D-03  0.140153D-02 -0.140830D+02
      5  -0.187467D+02 -0.375899D+01  0.435561D-03
      6  -0.976003D+00  0.142310D+01 -0.174277D-02
 Dipole-magnetic dipole polarizability for W=    0.088559:
                 1             2             3 
      1   0.846329D+01  0.541656D+01  0.948778D-04
      2  -0.259828D+02 -0.952296D+01 -0.668174D-03
      3   0.371681D-03  0.582309D-04  0.139577D+01
 DQ contribution to OR G for W=    0.088559:
                 1             2             3 
      1   0.103240D+02  0.235107D+01  0.451641D-03
      2  -0.223807D+02 -0.131070D+02 -0.138135D-02
      3  -0.156628D-02  0.110378D-02  0.278299D+01
 Optical Rotation G' tensor for W=    0.088559:
                 1             2             3 
      1  -0.148259D+01  0.263786D+01 -0.255970D-03
      2   0.263786D+01  0.165278D+01  0.117789D-03
      3  -0.255970D-03  0.117789D-03  0.165910D+00
 OR G Eigenvalues:    -2.9834     0.1659     3.1536  Iso=    -0.1120
 Eigenvectors:
   (1)   0.869163  -0.494526   0.000089
   (2)  -0.000073   0.000051   1.000000
   (3)   0.494526   0.869163  -0.000008
 w=    0.088559 a.u., Optical Rotation Beta=     -0.1120 au.
 Molar Mass =    150.0878 grams/mole, [Alpha] ( 5145.0 A) =      -37.85 deg.
 PxScal for PaGxPb-FJK:  IOpCl= 0 ISclPx=1 IMOff=     1 NMtTot=    25 NTT=   40470 ScalPx= 3.30D+01
 PxSclF for G(T1ab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   40470 IRwP= 19996     0 IPTmp= 19977     0 ScalPx= 5.12D+02
 FullF1:  Do perturbations      1 to      30.
          There are    36 degrees of freedom in the 2nd order CPHF.
     30 vectors produced by pass  0 Test12= 2.65D-14 2.78D-09 XBig12= 1.00D+00 4.28D-01.
     30 vectors produced by pass  1 Test12= 2.65D-14 2.78D-09 XBig12= 7.62D-02 6.06D-02.
     30 vectors produced by pass  2 Test12= 2.65D-14 2.78D-09 XBig12= 2.07D-03 7.50D-03.
     30 vectors produced by pass  3 Test12= 2.65D-14 2.78D-09 XBig12= 2.73D-05 1.03D-03.
     30 vectors produced by pass  4 Test12= 2.65D-14 2.78D-09 XBig12= 4.22D-07 9.85D-05.
     30 vectors produced by pass  5 Test12= 2.65D-14 2.78D-09 XBig12= 8.07D-09 1.34D-05.
     30 vectors produced by pass  6 Test12= 2.65D-14 2.78D-09 XBig12= 1.05D-10 1.09D-06.
     30 vectors produced by pass  7 Test12= 2.65D-14 2.78D-09 XBig12= 7.07D-13 8.27D-08.
     12 vectors produced by pass  8 Test12= 2.65D-14 2.78D-09 XBig12= 5.11D-15 8.09D-09.
 InvSVY:  IOpt=1 It=  1 EMax= 1.89D-15
 Solved reduced A of dimension   252 with    30 vectors.
 PxScal for FxTab-FJK:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   40470 ScalPx= 7.22D+02
 PxScal for FxTab-XC:  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    30 NTT=   40470 ScalPx= 7.22D+02
 PxSclF for G(Xab):  IOpCl= 0 ISclPx=1 IMOff=     0 NMtTot=    36 NTT=   40470 IRwP= 19978     0 IPTmp= 19973     0 ScalPx= 5.57D+02
 FullF1:  Do perturbations      1 to      30.
 End of Minotr F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) frequency  1    0.088559:
                 1             2             3 
      1   0.733376D+02 -0.604575D+01 -0.235849D-03
      2  -0.604575D+01  0.775211D+02  0.220631D-03
      3  -0.235849D-03  0.220631D-03  0.623877D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.088559:
                 1             2             3 
      1   0.846329D+01  0.541656D+01  0.948778D-04
      2  -0.259828D+02 -0.952296D+01 -0.668174D-03
      3   0.371681D-03  0.582309D-04  0.139577D+01
 Property number 4 -- D-Q polarizability frequency  1    0.088559:
                 1             2             3 
      1  -0.432222D-02  0.180311D-02 -0.411275D+02
      2   0.250531D-02 -0.511983D-03 -0.927970D+00
      3   0.181691D-02 -0.129113D-02  0.420554D+02
      4   0.236832D-03  0.140153D-02 -0.140830D+02
      5  -0.187467D+02 -0.375899D+01  0.435561D-03
      6  -0.976003D+00  0.142310D+01 -0.174277D-02
 End of Minotr F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    48 ND12= 1 LenFil=    1731:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1   0.110268D-01 -0.110807D+01  0.220525D+00  0.126208D+01 -0.109401D+01
      2  -0.110807D+01 -0.819930D+00 -0.810197D+00 -0.109401D+01  0.502948D+01
      3   0.220525D+00 -0.810197D+00 -0.813540D+00  0.109444D+00  0.100743D+01
                 6             7             8             9            10 
      1   0.109444D+00  0.136407D+01 -0.151470D+01 -0.189678D+00  0.162354D+01
      2   0.100743D+01 -0.151470D+01  0.129236D+01 -0.644596D+00 -0.252039D+01
      3   0.483239D+00 -0.189678D+00 -0.644596D+00 -0.179936D-01 -0.513829D+00
                11            12            13            14            15 
      1  -0.252039D+01 -0.513829D+00 -0.429196D+01  0.424244D+00 -0.109196D+01
      2  -0.147233D+00 -0.190877D-01  0.424244D+00 -0.112064D+02 -0.187217D+01
      3  -0.190877D-01  0.776004D+00 -0.109196D+01 -0.187217D+01 -0.295191D+01
                16            17            18            19            20 
      1  -0.108196D+01  0.302117D+00 -0.129121D-01 -0.567416D+01  0.146802D+01
      2   0.302117D+00 -0.258962D+01 -0.285320D+01  0.146802D+01 -0.874435D+00
      3  -0.129121D-01 -0.285320D+01 -0.246550D+01 -0.179895D+01  0.367449D+00
                21            22            23            24            25 
      1  -0.179895D+01 -0.678955D+00 -0.111858D+01 -0.456535D+00 -0.292253D+01
      2   0.367449D+00 -0.111858D+01 -0.137535D+01 -0.199912D+01  0.693054D+00
      3  -0.116245D+01 -0.456535D+00 -0.199912D+01 -0.548300D+00 -0.281815D+01
                26            27            28            29            30 
      1   0.693054D+00 -0.281815D+01 -0.395954D+01  0.159794D+01 -0.752840D-01
      2  -0.219327D+01  0.917860D+00  0.159794D+01  0.108267D+01  0.488866D-01
      3   0.917860D+00 -0.350907D+01 -0.752840D-01  0.488866D-01  0.229209D+01
                31            32            33            34            35 
      1   0.231002D+01  0.185562D+01 -0.622979D+00 -0.555746D+00  0.156259D+00
      2   0.185562D+01 -0.234635D+01 -0.726823D+00  0.156259D+00 -0.410237D+00
      3  -0.622979D+00 -0.726823D+00  0.314369D+01  0.213406D+01  0.200075D+01
                36            37            38            39            40 
      1   0.213406D+01  0.396007D+01 -0.159755D+01 -0.760078D-01 -0.230939D+01
      2   0.200075D+01 -0.159755D+01 -0.108270D+01  0.486986D-01 -0.185550D+01
      3  -0.240339D+01 -0.760078D-01  0.486986D-01 -0.229172D+01 -0.623009D+00
                41            42            43            44            45 
      1  -0.185550D+01 -0.623009D+00 -0.556274D+00  0.155929D+00 -0.213343D+01
      2   0.234691D+01 -0.727283D+00  0.155929D+00 -0.410725D+00 -0.200032D+01
      3  -0.727283D+00 -0.314325D+01 -0.213343D+01 -0.200032D+01 -0.240388D+01
                46            47            48            49            50 
      1  -0.118057D-01  0.110787D+01  0.220824D+00 -0.126279D+01  0.109346D+01
      2   0.110787D+01  0.819266D+00 -0.809919D+00  0.109346D+01 -0.503009D+01
      3   0.220824D+00 -0.809919D+00  0.812953D+00  0.109756D+00  0.100763D+01
                51            52            53            54            55 
      1   0.109756D+00  0.136423D+01 -0.151428D+01  0.189140D+00 -0.162307D+01
      2   0.100763D+01 -0.151428D+01  0.129214D+01  0.644359D+00  0.252045D+01
      3  -0.483454D+00  0.189140D+00  0.644359D+00 -0.178633D-01 -0.513735D+00
                56            57            58            59            60 
      1   0.252045D+01 -0.513735D+00  0.429231D+01 -0.423790D+00 -0.109213D+01
      2   0.147740D+00 -0.191686D-01 -0.423790D+00  0.112067D+02 -0.187212D+01
      3  -0.191686D-01 -0.775779D+00 -0.109213D+01 -0.187212D+01  0.295204D+01
                61            62            63            64            65 
      1  -0.108175D+01  0.302051D+00  0.131037D-01 -0.422985D+01  0.148874D+01
      2   0.302051D+00 -0.258922D+01  0.285311D+01  0.148874D+01 -0.202766D+01
      3   0.131037D-01  0.285311D+01 -0.246517D+01  0.165522D+01 -0.220366D+00
                66            67            68            69            70 
      1   0.165522D+01 -0.376664D+00 -0.215842D+01  0.931124D+00  0.273316D+01
      2  -0.220366D+00 -0.215842D+01  0.586286D+01  0.185999D+01 -0.719194D-01
      3  -0.193188D+01  0.931124D+00  0.185999D+01  0.857572D-01 -0.188733D+01
                71            72            73            74            75 
      1  -0.719194D-01 -0.188733D+01  0.422991D+01 -0.148860D+01  0.165517D+01
      2   0.199181D+01  0.154077D+01 -0.148860D+01  0.202844D+01 -0.220502D+00
      3   0.154077D+01  0.253508D+01  0.165517D+01 -0.220502D+00  0.193184D+01
                76            77            78            79            80 
      1   0.376834D+00  0.215879D+01  0.931020D+00  0.273240D+01 -0.718455D-01
      2   0.215879D+01 -0.586224D+01  0.186014D+01 -0.718455D-01  0.199192D+01
      3   0.931020D+00  0.186014D+01 -0.857996D-01  0.188691D+01 -0.154082D+01
                81            82            83            84            85 
      1   0.188691D+01  0.567378D+01 -0.146804D+01 -0.179899D+01  0.678778D+00
      2  -0.154082D+01 -0.146804D+01  0.874488D+00  0.367386D+00  0.111844D+01
      3   0.253468D+01 -0.179899D+01  0.367386D+00  0.116255D+01 -0.456459D+00
                86            87            88            89            90 
      1   0.111844D+01 -0.456459D+00 -0.292237D+01  0.693031D+00  0.281810D+01
      2   0.137545D+01 -0.199911D+01  0.693031D+00 -0.219324D+01 -0.917914D+00
      3  -0.199911D+01  0.548243D+00  0.281810D+01 -0.917914D+00 -0.350936D+01
                91            92            93            94            95 
      1  -0.139359D+01 -0.833770D+00  0.182063D+01 -0.139020D+01 -0.100038D+01
      2  -0.833770D+00 -0.852447D+00  0.272585D+00 -0.100038D+01 -0.108856D+01
      3   0.182063D+01  0.272585D+00 -0.234122D+01  0.557315D+00  0.151614D+01
                96            97            98            99           100 
      1   0.557315D+00  0.223077D+01  0.439775D+00 -0.224055D+01  0.139339D+01
      2   0.151614D+01  0.439775D+00  0.161881D+01 -0.138897D+01  0.833755D+00
      3  -0.225922D+01 -0.224055D+01 -0.138897D+01  0.635411D+01  0.182064D+01
               101           102           103           104           105 
      1   0.833755D+00  0.182064D+01  0.139011D+01  0.100038D+01  0.557302D+00
      2   0.852442D+00  0.272592D+00  0.100038D+01  0.108855D+01  0.151612D+01
      3   0.272592D+00  0.234109D+01  0.557302D+00  0.151612D+01  0.225916D+01
               106           107           108           109           110 
      1   0.223080D+01  0.439810D+00  0.224039D+01  0.877320D+00 -0.852162D+00
      2   0.439810D+00  0.161892D+01  0.138896D+01 -0.852162D+00  0.646912D+00
      3   0.224039D+01  0.138896D+01  0.635404D+01  0.384276D+00  0.153560D+00
               111           112           113           114           115 
      1   0.384276D+00 -0.269618D+01  0.119369D+01  0.103223D+01  0.123515D+01
      2   0.153560D+00  0.119369D+01 -0.433163D+01  0.407757D+00  0.136581D-01
      3  -0.860129D-02  0.103223D+01  0.407757D+00 -0.182995D+01 -0.388206D+00
               116           117           118           119           120 
      1   0.136581D-01 -0.388206D+00 -0.877227D+00  0.852162D+00  0.384389D+00
      2   0.104351D+01 -0.880753D+00  0.852162D+00 -0.646911D+00  0.153534D+00
      3  -0.880753D+00  0.542570D+00  0.384389D+00  0.153534D+00  0.858854D-02
               121           122           123           124           125 
      1   0.269638D+01 -0.119362D+01  0.103222D+01  0.123537D+01  0.136645D-01
      2  -0.119362D+01  0.433141D+01  0.407874D+00  0.136645D-01  0.104358D+01
      3   0.103222D+01  0.407874D+00  0.182987D+01  0.388179D+00  0.880763D+00
               126           127           128           129           130 
      1   0.388179D+00  0.363171D+01  0.343513D+00 -0.169258D+01  0.161170D+01
      2   0.880763D+00  0.343513D+00  0.105790D+01  0.207258D+00  0.312772D+00
      3   0.542581D+00 -0.169258D+01  0.207258D+00  0.147800D+01 -0.458667D+00
               131           132           133           134           135 
      1   0.312772D+00 -0.458667D+00 -0.300312D+01 -0.182624D-01  0.111443D+01
      2   0.251487D+01 -0.193260D+00 -0.182624D-01 -0.753431D+00  0.425310D+00
      3  -0.193260D+00  0.113632D+01  0.111443D+01  0.425310D+00 -0.103573D+01
               136           137           138           139           140 
      1  -0.363150D+01 -0.343863D+00 -0.169230D+01 -0.161209D+01 -0.313101D+00
      2  -0.343863D+00 -0.105855D+01  0.207292D+00 -0.313101D+00 -0.251565D+01
      3  -0.169230D+01  0.207292D+00 -0.147792D+01 -0.458677D+00 -0.193197D+00
               141           142           143           144 
      1  -0.458677D+00 -0.300220D+01 -0.183385D-01 -0.111405D+01
      2  -0.193197D+00 -0.183385D-01 -0.753295D+00 -0.425304D+00
      3  -0.113643D+01 -0.111405D+01 -0.425304D+00 -0.103511D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.192608D+01 -0.305266D+01 -0.255362D+01 -0.359836D+01 -0.464040D+01
      2   0.970822D+01  0.537093D+01  0.585240D+01  0.603099D+01 -0.692195D+00
      3   0.337955D+01 -0.509513D+01 -0.266186D+01 -0.553437D+01  0.381690D+01
                 6             7             8             9            10 
      1   0.272082D+01  0.466491D+00  0.415199D+01  0.357418D+01  0.225288D+01
      2   0.223250D+01 -0.445480D+01  0.424056D+00 -0.929965D+01 -0.470522D+00
      3   0.259942D+01 -0.735221D+01  0.493938D+01 -0.237059D+01 -0.662828D+01
                11            12            13            14            15 
      1   0.156310D+00  0.900927D+00 -0.223502D+01  0.435182D+01 -0.974201D+01
      2  -0.207394D+01  0.422212D+00 -0.165016D+01  0.337910D+01  0.288524D+01
      3  -0.782309D+00  0.237228D+00  0.139506D+02 -0.168454D+02 -0.509529D+00
                16            17            18            19            20 
      1  -0.160524D+01  0.194702D+01 -0.416638D+01 -0.178546D+00  0.228741D+01
      2  -0.402890D+01  0.508369D+01  0.551262D+01 -0.140745D+01 -0.111061D+01
      3   0.434527D+01 -0.383927D+01 -0.405378D+01  0.995131D+00 -0.679287D+01
                21            22            23            24            25 
      1   0.207695D+01  0.201229D+01  0.405175D+01  0.840627D+00 -0.476709D+00
      2   0.498852D+01 -0.817351D+00  0.431057D+01  0.678819D+00  0.287769D+01
      3   0.100800D+00 -0.149531D+01 -0.592007D+01 -0.650066D+01 -0.463131D+00
                26            27            28            29            30 
      1   0.626315D+01  0.136124D+01  0.191944D+01  0.133055D+01 -0.291882D+00
      2   0.826972D+00  0.108136D+02  0.875703D+01 -0.615308D+00  0.127043D+01
      3  -0.870942D+01  0.107648D+01  0.120180D+01 -0.176685D+01 -0.285851D+00
                31            32            33            34            35 
      1   0.286558D+01 -0.311348D+01 -0.120297D+01  0.545361D+00  0.349132D+01
      2  -0.498911D+01 -0.151142D+01  0.776805D+00 -0.592549D+01 -0.511024D+00
      3   0.345468D+01 -0.158742D+01 -0.152602D+01  0.100021D+00 -0.976923D+00
                36            37            38            39            40 
      1   0.207156D+01 -0.191880D+01 -0.133051D+01 -0.292024D+00 -0.286520D+01
      2   0.187729D+01 -0.875858D+01  0.614337D+00  0.127218D+01  0.498757D+01
      3   0.107112D+01  0.120108D+01 -0.176665D+01  0.285997D+00  0.345494D+01
                41            42            43            44            45 
      1   0.311494D+01 -0.120342D+01  0.544655D+00  0.349070D+01 -0.207083D+01
      2   0.151043D+01  0.777562D+00 -0.592369D+01 -0.509649D+00 -0.187943D+01
      3  -0.158857D+01  0.152646D+01 -0.994484D-01  0.977320D+00  0.107028D+01
                46            47            48            49            50 
      1   0.192522D+01  0.305236D+01 -0.255218D+01  0.359782D+01  0.463908D+01
      2  -0.970716D+01 -0.536929D+01  0.585141D+01 -0.602846D+01  0.693271D+00
      3   0.337938D+01 -0.509440D+01  0.266118D+01 -0.553501D+01  0.381731D+01
                51            52            53            54            55 
      1   0.272129D+01  0.466181D+00  0.415224D+01 -0.357331D+01 -0.225272D+01
      2   0.223052D+01 -0.445513D+01  0.423314D+00  0.930039D+01  0.471220D+00
      3  -0.259954D+01  0.735035D+01 -0.493882D+01 -0.236969D+01 -0.662733D+01
                56            57            58            59            60 
      1  -0.156488D+00  0.900123D+00  0.223477D+01 -0.435172D+01 -0.974190D+01
      2   0.207370D+01  0.422370D+00  0.164914D+01 -0.337908D+01  0.288597D+01
      3  -0.783184D+00 -0.237064D+00  0.139504D+02 -0.168447D+02  0.509389D+00
                61            62            63            64            65 
      1  -0.160517D+01  0.194713D+01  0.416562D+01 -0.400157D+01 -0.259281D+01
      2  -0.402902D+01  0.508320D+01 -0.551168D+01  0.617994D+00 -0.201773D+01
      3  -0.434439D+01  0.383890D+01 -0.405349D+01 -0.120532D+02 -0.587433D+01
                66            67            68            69            70 
      1   0.519368D+01 -0.571745D+01  0.522908D+01 -0.195554D+01  0.496216D+01
      2   0.416293D+01 -0.719854D+00  0.588899D+00 -0.204697D+01 -0.229072D+01
      3   0.564056D+01  0.260158D+00  0.402355D+01  0.546956D+01  0.900170D+01
                71            72            73            74            75 
      1   0.477450D+01 -0.381400D+01  0.400138D+01  0.259374D+01  0.519342D+01
      2  -0.136196D+01 -0.182249D+01 -0.618881D+00  0.201755D+01  0.416252D+01
      3   0.281832D+01 -0.308260D+01 -0.120533D+02 -0.587568D+01 -0.563980D+01
                76            77            78            79            80 
      1   0.571819D+01 -0.522862D+01 -0.195479D+01  0.496088D+01  0.477490D+01
      2   0.719999D+00 -0.589173D+00 -0.204697D+01 -0.229113D+01 -0.136196D+01
      3   0.258078D+00  0.402266D+01 -0.546990D+01 -0.899972D+01 -0.281868D+01
                81            82            83            84            85 
      1   0.381267D+01  0.178789D+00 -0.228733D+01  0.207650D+01 -0.201187D+01
      2   0.182228D+01  0.140764D+01  0.111023D+01  0.498818D+01  0.817076D+00
      3  -0.308119D+01  0.994970D+00 -0.679276D+01 -0.100732D+00 -0.149399D+01
                86            87            88            89            90 
      1  -0.405192D+01  0.840991D+00 -0.476455D+00  0.626339D+01 -0.136157D+01
      2  -0.431056D+01  0.679103D+00  0.287696D+01  0.826882D+00 -0.108135D+02
      3  -0.591971D+01  0.650026D+01  0.463144D+00  0.870895D+01  0.107656D+01
                91            92            93            94            95 
      1  -0.945378D+00 -0.128260D+01 -0.120545D-01 -0.121038D+01 -0.136824D+01
      2   0.255625D+00  0.537635D+00  0.857872D-01  0.174619D+01 -0.752091D-02
      3  -0.485476D+00 -0.170552D+01  0.192088D+00  0.301013D+00 -0.115902D+01
                96            97            98            99           100 
      1   0.103930D+01  0.141833D+00  0.340506D+01 -0.108792D+01  0.945300D+00
      2   0.721559D+00 -0.286602D+01  0.293220D+00 -0.226156D+01 -0.255252D+00
      3   0.162199D+01 -0.307791D+00  0.208591D+01 -0.641383D+00 -0.485295D+00
               101           102           103           104           105 
      1   0.128252D+01 -0.121718D-01  0.121039D+01  0.136793D+01  0.103919D+01
      2  -0.537654D+00  0.856596D-01 -0.174611D+01  0.751108D-02  0.721497D+00
      3  -0.170540D+01 -0.192021D+00  0.301147D+00 -0.115875D+01 -0.162193D+01
               106           107           108           109           110 
      1   0.141825D+00  0.340498D+01  0.108745D+01  0.148331D+01  0.101600D+01
      2  -0.286606D+01  0.293039D+00  0.226193D+01  0.533768D-01 -0.547539D+00
      3   0.307927D+00 -0.208601D+01 -0.641149D+00  0.274501D+01 -0.577448D+00
               111           112           113           114           115 
      1  -0.708890D+00  0.734746D+00  0.693805D+01 -0.370669D+01 -0.104517D+01
      2  -0.171127D+00  0.720964D+00  0.255266D+01 -0.469700D+01 -0.103614D+01
      3  -0.139235D+01  0.105927D+01  0.136833D+02 -0.381235D+01 -0.177985D+01
               116           117           118           119           120 
      1  -0.257357D+01  0.179600D+01 -0.148345D+01 -0.101625D+01 -0.708822D+00
      2  -0.311301D+01  0.320817D+01 -0.535061D-01  0.547581D+00 -0.171160D+00
      3  -0.561123D+01  0.357755D+01  0.274532D+01 -0.577100D+00  0.139244D+01
               121           122           123           124           125 
      1  -0.735057D+00 -0.693746D+01 -0.370644D+01 -0.104506D+01 -0.257342D+01
      2  -0.721129D+00 -0.255275D+01 -0.469695D+01 -0.103626D+01 -0.311306D+01
      3   0.105993D+01  0.136834D+02  0.381284D+01  0.178028D+01  0.561187D+01
               126           127           128           129           130 
      1  -0.179566D+01  0.693050D+01  0.213631D+01 -0.460501D+01  0.302448D+01
      2  -0.320823D+01 -0.159645D+01  0.490472D+00 -0.101416D+01 -0.494208D+00
      3   0.357762D+01  0.123565D+02  0.321441D+01 -0.677749D+01  0.633769D+01
               131           132           133           134           135 
      1   0.204500D+01 -0.359138D+01 -0.449962D+01 -0.207968D+01  0.377055D+01
      2   0.104149D+00 -0.550836D+00 -0.609776D+00 -0.130094D+00  0.174005D+01
      3   0.247561D+01 -0.265643D+01 -0.993876D+01 -0.261007D+01  0.442265D+01
               136           137           138           139           140 
      1  -0.693026D+01 -0.213655D+01 -0.460495D+01 -0.302480D+01 -0.204592D+01
      2   0.159657D+01 -0.490260D+00 -0.101363D+01  0.494456D+00 -0.103897D+00
      3   0.123567D+02  0.321485D+01  0.677678D+01  0.633879D+01  0.247741D+01
               141           142           143           144 
      1  -0.359161D+01 -0.449861D+01 -0.207934D+01 -0.376948D+01
      2  -0.550852D+00 -0.609489D+00 -0.130171D+00 -0.173966D+01
      3   0.265631D+01  0.993661D+01  0.260978D+01  0.442161D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.518935D+01 -0.875203D+00 -0.631387D+00  0.591129D+01  0.157937D+02
      2   0.255929D+01  0.160863D+01  0.375511D+01 -0.546006D+01 -0.237476D+02
      3   0.263006D+01 -0.733424D+00 -0.312372D+01 -0.451229D+00  0.795387D+01
      4   0.902543D+01  0.202334D+01  0.211386D+01 -0.870617D+01 -0.123176D+02
      5  -0.651812D+01  0.204890D+01 -0.183966D+00 -0.271419D+01 -0.191403D+01
      6  -0.120245D+01 -0.261720D+01  0.773255D+01 -0.379467D+01 -0.794708D+01
                 6             7             8             9            10 
      1   0.369029D+01 -0.107450D+02  0.858255D+01  0.329761D+01 -0.546152D+00
      2  -0.219698D+01  0.774602D+01 -0.873757D+01 -0.242469D+01  0.492148D+01
      3  -0.149331D+01  0.299896D+01  0.155020D+00 -0.872924D+00 -0.437533D+01
      4  -0.498549D+01 -0.400058D+00 -0.728550D+01  0.184353D+01  0.582003D+01
      5   0.488251D+01  0.622300D+00  0.427420D+01 -0.641264D+01  0.915226D+00
      6  -0.122923D+02  0.740018D+00 -0.129153D+01 -0.376410D+01  0.372620D+01
                11            12            13            14            15 
      1   0.905362D+01  0.269054D+01  0.900380D+01 -0.287755D+02 -0.357341D+01
      2  -0.408950D+01 -0.181945D+01 -0.328465D+01  0.477361D+02  0.316628D+01
      3  -0.496412D+01 -0.871086D+00 -0.571915D+01 -0.189606D+02  0.407128D+00
      4   0.134684D+02  0.245110D+01  0.152062D+02  0.322910D+02  0.578886D+01
      5   0.276438D+01  0.474349D+01  0.667806D+01  0.599180D+00  0.526671D+01
      6   0.392229D+00 -0.231045D+01  0.178437D+01  0.162919D+02  0.170962D+02
                16            17            18            19            20 
      1   0.395534D+01 -0.101532D+02 -0.110704D+02  0.415384D+02 -0.568185D+01
      2  -0.286622D+01  0.712860D+01  0.295520D+01 -0.250020D+02  0.271943D+01
      3  -0.108912D+01  0.302465D+01  0.811523D+01 -0.165364D+02  0.296243D+01
      4   0.304313D+01  0.753477D+01  0.834676D+01 -0.846636D+01  0.900868D+01
      5   0.562166D+01  0.588896D+01  0.593455D+01  0.152822D+02 -0.304608D+01
      6  -0.405486D+00  0.153874D+02  0.117956D+02 -0.340774D+01  0.304734D+01
                21            22            23            24            25 
      1   0.762415D+01 -0.319216D+00  0.211938D+01  0.272768D+01  0.133028D+02
      2  -0.674119D+01  0.251098D+00 -0.149470D+01 -0.203524D+01 -0.117027D+02
      3  -0.882958D+00  0.681181D-01 -0.624677D+00 -0.692438D+00 -0.160008D+01
      4  -0.279139D+01  0.111756D+02  0.430927D+01  0.891169D+01 -0.486886D+01
      5   0.142128D+02  0.782091D+00  0.945033D+01 -0.300102D+00  0.176147D+02
      6  -0.468332D+01  0.319167D+01 -0.204879D+01  0.775154D+01 -0.315503D+01
                26            27            28            29            30 
      1  -0.485980D+00  0.464625D+01  0.752869D+00 -0.277528D+01 -0.443619D+01
      2   0.666377D+00 -0.150287D+02  0.159946D+01  0.373213D+01 -0.414154D+01
      3  -0.180397D+00  0.103825D+02 -0.235233D+01 -0.956849D+00  0.857772D+01
      4   0.102735D+02 -0.373243D+01 -0.243971D+01 -0.135976D+01  0.174359D+01
      5  -0.525998D+01  0.196952D+02  0.807700D+00  0.122615D+01 -0.633858D+01
      6   0.686503D+01 -0.565255D+01  0.563058D+01  0.355029D+01 -0.141168D+01
                31            32            33            34            35 
      1   0.111533D+01  0.248728D+01 -0.314606D+01 -0.183354D+01 -0.344161D+01
      2   0.286509D+01 -0.435018D+01 -0.655989D+01 -0.349051D+01 -0.125003D+01
      3  -0.398042D+01  0.186291D+01  0.970594D+01  0.532405D+01  0.469164D+01
      4  -0.694901D+01  0.377928D+01  0.160447D+01  0.169171D+01  0.256843D+01
      5   0.229560D+01  0.473236D+01 -0.643116D+01 -0.490446D+01 -0.425552D+01
      6   0.183298D+01 -0.293228D+01 -0.778634D+01 -0.114643D+01  0.106224D+00
                36            37            38            39            40 
      1  -0.416757D+00  0.754332D+00 -0.277493D+01  0.443530D+01  0.111596D+01
      2   0.919496D+01  0.159911D+01  0.373243D+01  0.414146D+01  0.286426D+01
      3  -0.877820D+01 -0.235344D+01 -0.957502D+00 -0.857676D+01 -0.398022D+01
      4  -0.283301D+01 -0.243844D+01 -0.135960D+01 -0.174370D+01 -0.694878D+01
      5   0.134138D+02 -0.808390D+00 -0.122601D+01 -0.633760D+01 -0.229536D+01
      6   0.869874D+01 -0.563035D+01 -0.355081D+01 -0.141133D+01 -0.183364D+01
                41            42            43            44            45 
      1   0.248771D+01  0.314515D+01  0.183233D+01  0.344030D+01 -0.415685D+00
      2  -0.434985D+01  0.655954D+01  0.349023D+01  0.125079D+01  0.919406D+01
      3   0.186213D+01 -0.970470D+01 -0.532257D+01 -0.469109D+01 -0.877838D+01
      4   0.378115D+01 -0.160579D+01 -0.169222D+01 -0.256941D+01 -0.283207D+01
      5  -0.473388D+01 -0.643002D+01 -0.490217D+01 -0.425430D+01 -0.134150D+02
      6   0.293297D+01 -0.778741D+01 -0.114609D+01  0.106325D+00 -0.869899D+01
                46            47            48            49            50 
      1  -0.519014D+01 -0.874331D+00  0.631624D+00  0.591045D+01  0.157922D+02
      2   0.255972D+01  0.160697D+01 -0.375542D+01 -0.546011D+01 -0.237475D+02
      3   0.263042D+01 -0.732637D+00  0.312379D+01 -0.450342D+00  0.795528D+01
      4   0.902457D+01  0.202155D+01 -0.211315D+01 -0.870840D+01 -0.123195D+02
      5   0.651924D+01 -0.204835D+01 -0.184993D+00  0.271475D+01  0.191426D+01
      6   0.120245D+01  0.261812D+01  0.773118D+01  0.379444D+01  0.794723D+01
                51            52            53            54            55 
      1  -0.368919D+01  0.107446D+02 -0.858049D+01  0.329645D+01 -0.543876D+00
      2   0.219728D+01 -0.774497D+01  0.873606D+01 -0.242446D+01  0.492058D+01
      3   0.149191D+01 -0.299964D+01 -0.155570D+00 -0.871985D+00 -0.437670D+01
      4   0.498537D+01  0.400191D+00  0.728504D+01  0.184302D+01  0.582135D+01
      5   0.488144D+01  0.620793D+00  0.427344D+01  0.641323D+01 -0.915716D+00
      6  -0.122918D+02  0.739529D+00 -0.129177D+01  0.376312D+01 -0.372595D+01
                56            57            58            59            60 
      1   0.905291D+01 -0.268988D+01  0.900323D+01 -0.287741D+02  0.357252D+01
      2  -0.408806D+01  0.181938D+01 -0.328336D+01  0.477363D+02 -0.316603D+01
      3  -0.496485D+01  0.870501D+00 -0.571987D+01 -0.189622D+02 -0.406493D+00
      4   0.134707D+02 -0.245098D+01  0.152078D+02  0.322928D+02 -0.578847D+01
      5  -0.276416D+01  0.474387D+01 -0.667848D+01 -0.598844D+00  0.526756D+01
      6  -0.393178D+00 -0.230937D+01 -0.178437D+01 -0.162919D+02  0.170954D+02
                61            62            63            64            65 
      1  -0.395451D+01  0.101520D+02 -0.110691D+02  0.740466D+01  0.120408D+01
      2   0.286586D+01 -0.712722D+01  0.295541D+01 -0.387961D+01 -0.501708D+01
      3   0.108865D+01 -0.302473D+01  0.811366D+01 -0.352505D+01  0.381299D+01
      4  -0.304290D+01 -0.753373D+01  0.834695D+01 -0.112230D+02  0.107167D+02
      5   0.562191D+01  0.588910D+01 -0.593389D+01 -0.256994D+01  0.219875D+01
      6  -0.404633D+00  0.153871D+02 -0.117945D+02  0.821243D+01 -0.452133D+01
                66            67            68            69            70 
      1   0.206220D+01 -0.914572D+00 -0.118862D+02 -0.393218D+01  0.843633D+00
      2   0.108749D+01 -0.429392D+01  0.205023D+02  0.551410D+01  0.100052D+01
      3  -0.314969D+01  0.520850D+01 -0.861608D+01 -0.158192D+01 -0.184415D+01
      4   0.419757D+01  0.101909D+02 -0.141393D+02 -0.239769D+01  0.660255D+01
      5   0.905596D+01  0.130606D+01 -0.788328D+01 -0.185351D+01  0.740308D+01
      6  -0.527592D+01 -0.163622D+01  0.130385D+02  0.117420D+02 -0.549734D+01
                71            72            73            74            75 
      1  -0.588533D+01 -0.568174D+01  0.740579D+01  0.120569D+01 -0.206173D+01
      2   0.428527D+01 -0.326706D+01 -0.388125D+01 -0.501987D+01 -0.108766D+01
      3   0.160006D+01  0.894879D+01 -0.352454D+01  0.381418D+01  0.314939D+01
      4  -0.471026D+01 -0.572543D+01 -0.112236D+02  0.107164D+02 -0.419763D+01
      5  -0.402045D+01 -0.493246D+01  0.257131D+01 -0.219916D+01  0.905641D+01
      6   0.931940D+01  0.978589D+01 -0.821196D+01  0.452208D+01 -0.527592D+01
                76            77            78            79            80 
      1  -0.913564D+00 -0.118839D+02  0.393239D+01 -0.842925D+00  0.588593D+01
      2  -0.429498D+01  0.204984D+02 -0.551424D+01 -0.100104D+01 -0.428610D+01
      3   0.520855D+01 -0.861454D+01  0.158185D+01  0.184396D+01 -0.159983D+01
      4   0.101906D+02 -0.141405D+02  0.239833D+01 -0.660153D+01  0.470965D+01
      5  -0.130618D+01  0.788451D+01 -0.185410D+01  0.740327D+01 -0.402079D+01
      6   0.163684D+01 -0.130385D+02  0.117423D+02 -0.549610D+01  0.931896D+01
                81            82            83            84            85 
      1  -0.568118D+01  0.415352D+02 -0.568218D+01 -0.762424D+01 -0.319800D+00
      2  -0.326757D+01 -0.250007D+02  0.271988D+01  0.674133D+01  0.251470D+00
      3   0.894875D+01 -0.165345D+02  0.296230D+01  0.882908D+00  0.683297D-01
      4  -0.572507D+01 -0.846660D+01  0.900844D+01  0.279107D+01  0.111750D+02
      5   0.493244D+01 -0.152826D+02  0.304595D+01  0.142127D+02 -0.781929D+00
      6  -0.978499D+01  0.340742D+01 -0.304739D+01 -0.468298D+01 -0.319108D+01
                86            87            88            89            90 
      1   0.211887D+01 -0.272776D+01 -0.133018D+02  0.485677D+00  0.464526D+01
      2  -0.149498D+01  0.203510D+01  0.117020D+02 -0.666373D+00 -0.150288D+02
      3  -0.623891D+00  0.692659D+00  0.159979D+01  0.180696D+00  0.103835D+02
      4   0.430949D+01 -0.891118D+01  0.486898D+01 -0.102733D+02 -0.373263D+01
      5  -0.944979D+01 -0.300294D+00  0.176143D+02 -0.526006D+01 -0.196957D+02
      6   0.204869D+01  0.775112D+01 -0.315501D+01  0.686544D+01  0.565301D+01
                91            92            93            94            95 
      1   0.307385D+01  0.134324D+01 -0.340277D+00  0.638955D+00 -0.221294D+01
      2  -0.690804D+01 -0.180142D+01  0.685352D+01 -0.167184D+01 -0.167184D+01
      3   0.383419D+01  0.458181D+00 -0.651324D+01  0.103288D+01  0.388477D+01
      4   0.278064D+01  0.331631D+01 -0.175340D+01  0.423504D+01  0.334470D+01
      5  -0.919331D+01 -0.240066D+01  0.126372D+02 -0.355291D+01 -0.525840D+01
      6  -0.320595D+01 -0.249072D+01  0.268727D+01 -0.300141D+01 -0.528199D+01
                96            97            98            99           100 
      1   0.371035D+01 -0.245779D+00  0.243740D+01 -0.977286D+01  0.307355D+01
      2   0.378113D+01  0.666938D+01  0.274256D+01 -0.164767D+02 -0.690769D+01
      3  -0.749148D+01 -0.642360D+01 -0.517996D+01  0.262495D+02  0.383414D+01
      4  -0.392965D+01 -0.196520D+01 -0.367498D+01  0.336610D+01  0.278062D+01
      5   0.707666D+01  0.116881D+02  0.428965D+01 -0.200275D+02  0.919303D+01
      6   0.892976D+01  0.259035D+01  0.632509D+01 -0.859060D+01  0.320626D+01
               101           102           103           104           105 
      1   0.134322D+01  0.340491D+00  0.638896D+00 -0.221295D+01 -0.371017D+01
      2  -0.180140D+01 -0.685307D+01 -0.167161D+01 -0.167170D+01 -0.378083D+01
      3   0.458176D+00  0.651258D+01  0.103272D+01  0.388466D+01  0.749100D+01
      4   0.331639D+01  0.175353D+01  0.423504D+01  0.334478D+01  0.392975D+01
      5   0.240072D+01  0.126366D+02  0.355275D+01  0.525844D+01  0.707654D+01
      6   0.249075D+01  0.268731D+01  0.300143D+01  0.528212D+01  0.892977D+01
               106           107           108           109           110 
      1   0.246106D+00 -0.243740D+01 -0.977267D+01  0.384691D+01 -0.388277D+01
      2  -0.666904D+01 -0.274260D+01 -0.164759D+02 -0.641911D+00  0.611636D+00
      3   0.642293D+01  0.517999D+01  0.262485D+02 -0.320500D+01  0.327114D+01
      4   0.196537D+01  0.367527D+01  0.336628D+01 -0.479630D+01  0.413931D+01
      5   0.116875D+02  0.428981D+01  0.200274D+02  0.190554D+01  0.666624D+00
      6   0.259049D+01  0.632522D+01  0.859133D+01 -0.909895D-01 -0.130237D+00
               111           112           113           114           115 
      1   0.104775D+01 -0.111181D+02  0.270401D+01  0.261503D+01  0.661578D+01
      2  -0.112566D+01  0.475879D+01  0.374739D+01 -0.357488D+01 -0.343207D+01
      3   0.779067D-01  0.635935D+01 -0.645140D+01  0.959845D+00 -0.318371D+01
      4  -0.460298D+00  0.772616D+01 -0.195292D+02  0.809370D+00 -0.768092D+00
      5   0.136821D-01  0.501094D+01  0.182573D+01 -0.722043D+01 -0.111474D+01
      6  -0.222181D-01 -0.241955D+01  0.472649D+01  0.195061D+01  0.522658D+00
               116           117           118           119           120 
      1  -0.102847D+01 -0.174376D+01  0.384650D+01 -0.388273D+01 -0.104818D+01
      2  -0.238521D+00  0.227497D+01 -0.641614D+00  0.611492D+00  0.112595D+01
      3   0.126699D+01 -0.531208D+00 -0.320488D+01  0.327124D+01 -0.777758D-01
      4   0.453230D+01 -0.287878D+01 -0.479623D+01  0.413923D+01  0.460473D+00
      5  -0.348457D+01  0.341354D+01 -0.190606D+01 -0.666416D+00  0.136311D-01
      6   0.752361D+00  0.158262D+00  0.911657D-01  0.130060D+00 -0.223137D-01
               121           122           123           124           125 
      1  -0.111192D+02  0.270425D+01 -0.261505D+01 -0.661675D+01  0.102850D+01
      2   0.475941D+01  0.374685D+01  0.357488D+01  0.343269D+01  0.238397D+00
      3   0.635979D+01 -0.645109D+01 -0.959830D+00  0.318405D+01 -0.126690D+01
      4   0.772614D+01 -0.195288D+02 -0.809966D+00  0.768361D+00 -0.453277D+01
      5  -0.501073D+01 -0.182638D+01 -0.722041D+01 -0.111448D+01 -0.348477D+01
      6   0.241923D+01 -0.472584D+01  0.195017D+01  0.522486D+00  0.752271D+00
               126           127           128           129           130 
      1  -0.174359D+01 -0.198931D+01 -0.241635D+01 -0.299277D+01 -0.230078D+01
      2   0.227478D+01  0.290514D+01  0.425126D+01 -0.576541D+00  0.280377D+01
      3  -0.531193D+00 -0.915827D+00 -0.183491D+01  0.356931D+01 -0.502992D+00
      4  -0.287899D+01  0.627601D+01 -0.255351D+01 -0.223455D+01  0.379025D+01
      5  -0.341385D+01  0.160421D+01  0.122752D+01 -0.294703D+01  0.165400D+01
      6  -0.158365D+00 -0.444185D+01  0.404633D+01  0.328355D+01 -0.101407D+01
               131           132           133           134           135 
      1  -0.607026D+01 -0.177231D+00  0.140522D+01  0.173318D+01 -0.545546D-01
      2   0.109594D+02 -0.200067D+01 -0.130959D+01 -0.364831D+01  0.197645D+01
      3  -0.488918D+01  0.217790D+01 -0.956341D-01  0.191513D+01 -0.192189D+01
      4  -0.761864D+00 -0.514198D+00 -0.497413D+01  0.350418D+01  0.161312D+01
      5   0.738249D+00 -0.142061D+01 -0.262266D+00 -0.455195D+00  0.236964D+01
      6   0.148145D+01  0.380329D+01  0.332789D+01  0.129649D+01 -0.250632D+01
               136           137           138           139           140 
      1  -0.198982D+01 -0.241814D+01  0.299228D+01 -0.230214D+01 -0.607226D+01
      2   0.290629D+01  0.425399D+01  0.576436D+00  0.280565D+01  0.109630D+02
      3  -0.916469D+00 -0.183585D+01 -0.356872D+01 -0.503504D+00 -0.489072D+01
      4   0.627593D+01 -0.255144D+01  0.223411D+01  0.379110D+01 -0.761515D+00
      5  -0.160458D+01 -0.122794D+01 -0.294640D+01 -0.165446D+01 -0.738453D+00
      6   0.444074D+01 -0.404631D+01  0.328364D+01  0.101382D+01 -0.148270D+01
               141           142           143           144 
      1   0.177498D+00 -0.140538D+01 -0.173311D+01 -0.551211D-01
      2   0.200071D+01  0.130960D+01  0.364852D+01  0.197618D+01
      3  -0.217821D+01  0.957876D-01 -0.191540D+01 -0.192106D+01
      4   0.514374D+00  0.497269D+01 -0.350319D+01  0.161266D+01
      5  -0.142078D+01 -0.261859D+00 -0.455258D+00 -0.236893D+01
      6   0.380345D+01  0.332694D+01  0.129706D+01  0.250473D+01
 End of Minotr F.D. properties file   788 does not exist.
 Leave Link 1002 at Wed Jul 28 20:01:36 2021, MaxMem=  5637144576 cpu:           20039.0 elap:            2547.9
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l601.exe)
 Copying SCF densities to generalized density rwf, IOpCl= 0 IROHF=0.

 **********************************************************************

            Population analysis using the SCF density.

 **********************************************************************

 Orbital symmetries:
       Occupied  (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A)
       Virtual   (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A) (A)
                 (A) (A) (A) (A) (A)
 The electronic state is 1-A.
 Alpha  occ. eigenvalues --  -19.03429 -19.03428 -19.00544 -19.00543 -18.98541
 Alpha  occ. eigenvalues --  -18.98540 -10.25011 -10.25011 -10.19152 -10.19145
 Alpha  occ. eigenvalues --   -1.27801  -1.27057  -1.20523  -1.20275  -1.18490
 Alpha  occ. eigenvalues --   -1.17258  -0.93910  -0.86048  -0.77410  -0.77401
 Alpha  occ. eigenvalues --   -0.73955  -0.70094  -0.69955  -0.64379  -0.63809
 Alpha  occ. eigenvalues --   -0.61688  -0.60991  -0.58898  -0.57421  -0.56819
 Alpha  occ. eigenvalues --   -0.53322  -0.52702  -0.49746  -0.49103  -0.47859
 Alpha  occ. eigenvalues --   -0.47194  -0.46992  -0.41211  -0.40747
 Alpha virt. eigenvalues --    0.02243   0.03849   0.04230   0.04376   0.05879
 Alpha virt. eigenvalues --    0.05889   0.06977   0.07080   0.08294   0.09814
 Alpha virt. eigenvalues --    0.10326   0.11011   0.12301   0.12532   0.13390
 Alpha virt. eigenvalues --    0.13710   0.13954   0.14211   0.14896   0.14983
 Alpha virt. eigenvalues --    0.17178   0.17190   0.17932   0.20167   0.20934
 Alpha virt. eigenvalues --    0.22044   0.22425   0.22730   0.24227   0.24562
 Alpha virt. eigenvalues --    0.25347   0.25630   0.26639   0.26789   0.27511
 Alpha virt. eigenvalues --    0.27605   0.28343   0.28893   0.29604   0.30014
 Alpha virt. eigenvalues --    0.30511   0.31453   0.31466   0.31873   0.32644
 Alpha virt. eigenvalues --    0.33696   0.33858   0.34178   0.34866   0.35258
 Alpha virt. eigenvalues --    0.35714   0.36926   0.37208   0.38748   0.39804
 Alpha virt. eigenvalues --    0.40961   0.41577   0.43464   0.44258   0.44710
 Alpha virt. eigenvalues --    0.45001   0.45938   0.47587   0.47941   0.49782
 Alpha virt. eigenvalues --    0.50258   0.50594   0.52555   0.53295   0.53623
 Alpha virt. eigenvalues --    0.54818   0.55506   0.57459   0.57902   0.59784
 Alpha virt. eigenvalues --    0.60609   0.61540   0.61841   0.64269   0.64653
 Alpha virt. eigenvalues --    0.66077   0.66758   0.66971   0.67071   0.68729
 Alpha virt. eigenvalues --    0.69509   0.70438   0.72007   0.72049   0.73862
 Alpha virt. eigenvalues --    0.74318   0.76642   0.76930   0.77796   0.78911
 Alpha virt. eigenvalues --    0.80625   0.81469   0.83384   0.85458   0.86074
 Alpha virt. eigenvalues --    0.87329   0.87558   0.90010   0.91226   0.92231
 Alpha virt. eigenvalues --    0.93240   0.94311   0.96757   0.97738   0.99763
 Alpha virt. eigenvalues --    1.02249   1.03567   1.04295   1.07223   1.07824
 Alpha virt. eigenvalues --    1.10403   1.10797   1.11232   1.12472   1.14078
 Alpha virt. eigenvalues --    1.14633   1.15688   1.17228   1.17850   1.20471
 Alpha virt. eigenvalues --    1.22463   1.23644   1.24693   1.25203   1.26825
 Alpha virt. eigenvalues --    1.27656   1.29082   1.30196   1.31501   1.31799
 Alpha virt. eigenvalues --    1.34437   1.35522   1.36628   1.38922   1.39999
 Alpha virt. eigenvalues --    1.42408   1.42999   1.46802   1.48659   1.50152
 Alpha virt. eigenvalues --    1.50520   1.50865   1.55192   1.56125   1.56982
 Alpha virt. eigenvalues --    1.57679   1.59946   1.61681   1.63456   1.64442
 Alpha virt. eigenvalues --    1.67869   1.68006   1.73092   1.74561   1.77125
 Alpha virt. eigenvalues --    1.78795   1.79087   1.82166   1.85261   1.85522
 Alpha virt. eigenvalues --    1.85598   1.88587   1.89690   1.92270   1.93775
 Alpha virt. eigenvalues --    1.96198   1.96502   1.99125   2.01314   2.01799
 Alpha virt. eigenvalues --    2.05900   2.06030   2.09996   2.13631   2.14247
 Alpha virt. eigenvalues --    2.17162   2.18704   2.20566   2.23261   2.25748
 Alpha virt. eigenvalues --    2.27497   2.28499   2.29704   2.33491   2.34270
 Alpha virt. eigenvalues --    2.38681   2.39655   2.42878   2.43164   2.48959
 Alpha virt. eigenvalues --    2.49849   2.55073   2.58945   2.61308   2.61688
 Alpha virt. eigenvalues --    2.67207   2.73654   2.75511   2.81005   2.83150
 Alpha virt. eigenvalues --    2.86595   2.86782   2.97201   3.05063   3.10667
 Alpha virt. eigenvalues --    3.23207   3.28158   3.31075   3.35168   3.35392
 Alpha virt. eigenvalues --    3.41249   3.42223   3.42690   3.44296   3.44506
 Alpha virt. eigenvalues --    3.47136   3.49437   3.49947   3.50552   3.52460
 Alpha virt. eigenvalues --    3.53189   3.53864   3.54466   3.58380   3.58871
 Alpha virt. eigenvalues --    3.62117   3.65153   3.68805   3.68908   3.73249
 Alpha virt. eigenvalues --    3.74942   3.78903   3.79231   3.87156   3.88782
 Alpha virt. eigenvalues --    3.89431   4.03386   4.05797   4.10221   4.10241
          Condensed to atoms (all electrons):
               1          2          3          4          5          6
     1  C    6.117046   0.224590  -0.160631  -0.486032  -0.126349  -0.110693
     2  O    0.224590   8.265279  -0.107282   0.040399   0.008528   0.011157
     3  O   -0.160631  -0.107282   8.301723   0.108405   0.008011   0.018932
     4  C   -0.486032   0.040399   0.108405   5.959695  -0.004893  -0.126380
     5  C   -0.126349   0.008528   0.008011  -0.004893   5.959600  -0.486048
     6  C   -0.110693   0.011157   0.018932  -0.126380  -0.486048   6.117116
     7  O    0.011155   0.000238   0.002818   0.008551   0.040396   0.224568
     8  O    0.052984  -0.014761  -0.047029  -0.135710   0.037792  -0.007863
     9  O   -0.007861  -0.034388  -0.004206   0.037772  -0.135692   0.052991
    10  O    0.018928   0.002822  -0.001425   0.008025   0.108380  -0.160645
    11  H   -0.149704   0.011169   0.016134  -0.072508   0.197032   0.005651
    12  H    0.005645   0.005662   0.003345   0.197077  -0.072513  -0.149727
    13  H   -0.007680  -0.001616   0.001006  -0.007193  -0.036695  -0.060776
    14  H   -0.060764   0.018138   0.256609  -0.036713  -0.007197  -0.007678
    15  H   -0.040969   0.003466  -0.001611   0.017771  -0.012263  -0.033915
    16  H   -0.033899   0.060356   0.005477  -0.012257   0.017803  -0.040962
               7          8          9         10         11         12
     1  C    0.011155   0.052984  -0.007861   0.018928  -0.149704   0.005645
     2  O    0.000238  -0.014761  -0.034388   0.002822   0.011169   0.005662
     3  O    0.002818  -0.047029  -0.004206  -0.001425   0.016134   0.003345
     4  C    0.008551  -0.135710   0.037772   0.008025  -0.072508   0.197077
     5  C    0.040396   0.037792  -0.135692   0.108380   0.197032  -0.072513
     6  C    0.224568  -0.007863   0.052991  -0.160645   0.005651  -0.149727
     7  O    8.265329  -0.034399  -0.014759  -0.107287   0.005660   0.011167
     8  O   -0.034399   8.464697   0.005150  -0.004207  -0.117272   0.010526
     9  O   -0.014759   0.005150   8.464655  -0.047029   0.010523  -0.117250
    10  O   -0.107287  -0.004207  -0.047029   8.301752   0.003345   0.016139
    11  H    0.005660  -0.117272   0.010523   0.003345   1.417300  -0.117827
    12  H    0.011167   0.010526  -0.117250   0.016139  -0.117827   1.417256
    13  H    0.018138  -0.000656   0.028919   0.256610   0.000294   0.006960
    14  H   -0.001615   0.028918  -0.000656   0.001006   0.006961   0.000294
    15  H    0.060364   0.239750  -0.001645   0.005480   0.019386  -0.002214
    16  H    0.003464  -0.001645   0.239776  -0.001614  -0.002208   0.019372
              13         14         15         16
     1  C   -0.007680  -0.060764  -0.040969  -0.033899
     2  O   -0.001616   0.018138   0.003466   0.060356
     3  O    0.001006   0.256609  -0.001611   0.005477
     4  C   -0.007193  -0.036713   0.017771  -0.012257
     5  C   -0.036695  -0.007197  -0.012263   0.017803
     6  C   -0.060776  -0.007678  -0.033915  -0.040962
     7  O    0.018138  -0.001615   0.060364   0.003464
     8  O   -0.000656   0.028918   0.239750  -0.001645
     9  O    0.028919  -0.000656  -0.001645   0.239776
    10  O    0.256610   0.001006   0.005480  -0.001614
    11  H    0.000294   0.006961   0.019386  -0.002208
    12  H    0.006960   0.000294  -0.002214   0.019372
    13  H    0.610543  -0.000431  -0.000605   0.008529
    14  H   -0.000431   0.610548   0.008537  -0.000605
    15  H   -0.000605   0.008537   0.577875  -0.000729
    16  H    0.008529  -0.000605  -0.000729   0.577836
 Mulliken charges:
               1
     1  C    0.754234
     2  O   -0.493755
     3  O   -0.400275
     4  C    0.503991
     5  C    0.504107
     6  C    0.754271
     7  O   -0.493788
     8  O   -0.476275
     9  O   -0.476301
    10  O   -0.400281
    11  H   -0.233938
    12  H   -0.233913
    13  H    0.184649
    14  H    0.184647
    15  H    0.161320
    16  H    0.161306
 Sum of Mulliken charges =  -0.00000
 Mulliken charges with hydrogens summed into heavy atoms:
               1
     1  C    0.754234
     2  O   -0.493755
     3  O   -0.215628
     4  C    0.270053
     5  C    0.270194
     6  C    0.754271
     7  O   -0.493788
     8  O   -0.314955
     9  O   -0.314995
    10  O   -0.215631
 Electronic spatial extent (au):  <R**2>=           1291.7279
 Charge=              0.0000 electrons
 Dipole moment (field-independent basis, Debye):
    X=             -0.0000    Y=             -0.0003    Z=              2.4712  Tot=              2.4712
 Quadrupole moment (field-independent basis, Debye-Ang):
   XX=            -59.1002   YY=            -62.2025   ZZ=            -60.4386
   XY=             -5.6789   XZ=             -0.0005   YZ=             -0.0005
 Traceless Quadrupole moment (field-independent basis, Debye-Ang):
   XX=              1.4802   YY=             -1.6221   ZZ=              0.1419
   XY=             -5.6789   XZ=             -0.0005   YZ=             -0.0005
 Octapole moment (field-independent basis, Debye-Ang**2):
  XXX=              0.0006  YYY=             -0.0034  ZZZ=              3.4646  XYY=              0.0000
  XXY=              0.0002  XXZ=             10.7216  XZZ=             -0.0003  YZZ=              0.0001
  YYZ=             -4.1882  XYZ=             14.6684
 Hexadecapole moment (field-independent basis, Debye-Ang**3):
 XXXX=           -814.4992 YYYY=           -456.2112 ZZZZ=           -267.2594 XXXY=            -40.1763
 XXXZ=             -0.0028 YYYX=            -28.9613 YYYZ=             -0.0039 ZZZX=             -0.0005
 ZZZY=              0.0009 XXYY=           -210.5195 XXZZ=           -194.6151 YYZZ=           -138.2999
 XXYZ=              0.0016 YYXZ=             -0.0010 ZZXY=              3.1970
 N-N= 5.913890664853D+02 E-N=-2.607616867829D+03  KE= 6.028772061258D+02
 No NMR shielding tensors so no spin-rotation constants.
 Leave Link  601 at Wed Jul 28 20:01:37 2021, MaxMem=  5637144576 cpu:               5.6 elap:               0.9
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l716.exe)
 Electric field and nuclear coordinate derivatives read from checkpoint file.
 Rotating derivatives to standard orientation.
 Dipole        =-2.19188643D-05-1.01865537D-04 9.35564656D-01
 Polarizability= 6.82333002D+01-5.89844644D+00 7.18317221D+01
                -2.96794281D-04 1.99158540D-04 5.71173438D+01
 Translational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 2     -0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 3      0.0000    0.0000        0.0000    0.0000        0.0000    0.0000
 4     -0.0000    0.0000       -0.0000    0.0000       -0.0000    0.0000
 5      0.0000    0.0000       -0.0000    0.0000        0.0000    0.0000
 6     -0.0000    0.0000        0.0000    0.0000       -0.0000    0.0000
 Translational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000        0.0001    0.0001       -3.0227   -3.0229
 2     -0.0001   -0.0001       -0.0001   -0.0001        2.0924    2.0918
 3      3.0227    3.0229        5.4735    5.4749        0.0001    0.0001
 4      0.0001    0.0001       -0.0000    0.0000        3.0235    3.0229
 5     -7.5658   -7.5667       -3.0235   -3.0229        0.0001    0.0001
 6     -0.0001   -0.0001       -0.0001   -0.0001        0.0000    0.0000
 Translational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0000    0.0000       -0.0004   -0.0004       -9.0686   -9.0686
 2      0.0003    0.0003        0.0000    0.0000       -9.0686   -9.0686
 3      0.0003    0.0003       -0.0004   -0.0004       -0.0000    0.0000
 4     -0.0004   -0.0004       -0.0003   -0.0003        6.2753    6.2753
 5      9.0686    9.0686       16.4247   16.4247        0.0003    0.0003
 6    -22.7000  -22.7000       -9.0686   -9.0686        0.0004    0.0004
 Rotational dAlpha, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000       -0.0004   -0.0005       12.0632   12.0915
 2      0.0005    0.0005        0.0004    0.0004       -8.4040   -8.3670
 3    -12.0455  -12.0915      -21.9224  -21.8996       -0.0004   -0.0004
 4     -0.0004   -0.0004       -0.0000    0.0000      -12.1257  -12.0915
 5     30.2954   30.2667       12.0755   12.0915       -0.0005   -0.0005
 6      0.0004    0.0004        0.0005    0.0005       -0.0139    0.0000
 Rotational dG, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1     -0.0000    0.0000        0.0005    0.0005       20.5919   20.5663
 2     -0.0005   -0.0005       -0.0006   -0.0006       35.9612   35.9725
 3    -20.5127  -20.5663      -14.2006  -14.1350        0.0005    0.0006
 4      0.0006    0.0006        0.0000    0.0000      -20.6024  -20.5663
 5    -21.8487  -21.8375       20.5253   20.5663        0.0005    0.0005
 6     -0.0006   -0.0006       -0.0005   -0.0005        0.0191    0.0000
 Rotational dA, IFr= 1:
                x                       y                       z
         lhs       rhs           lhs       rhs           lhs       rhs
 1      0.0007    0.0007       -0.0020   -0.0020      -20.0751  -20.1698
 2      0.0010    0.0010       -0.0031   -0.0031      -20.1394  -20.1698
 3      0.0010    0.0010       -0.0020   -0.0020      -40.1859  -40.1995
 4      0.0011    0.0011       -0.0003   -0.0003       46.8545   46.8621
 5    -19.9658  -20.0297      -15.1649  -15.0821        0.0002    0.0003
 6    -31.7721  -31.7800       20.0223   20.0297       -0.0012   -0.0011
 Full mass-weighted force constant matrix:
 Low frequencies ---   -5.5824   -4.8554   -2.4419    0.0002    0.0005    0.0006
 Low frequencies ---   60.1483   80.2874   98.5271
 Diagonal vibrational polarizability:
       56.9005948      18.0374059      31.6821870
 Harmonic frequencies (cm**-1), IR intensities (KM/Mole), Raman scattering
 activities (A**4/AMU), depolarization ratios for plane and unpolarized
 incident light, reduced masses (AMU), force constants (mDyne/A),
 Raman invariants Alpha2 = alpha**2, Beta2 = beta(alpha)**2 (A**4/AMU)
 ROA invariants AlphaG = alphaG', Gamma2 = beta(G')**2, Delta2 = beta(A)**2, (10**4 A**5/AMU)
 Far-From-Resonance Raman intensities (K), ROA intensites (10**4 K), CID=(ROA/Raman)*10**4
    Raman1;ROA1;CID1 =ICPu/SCPu(180), Raman2;ROA2;CID2 =ICPd/SCPd(90)
    Raman3;ROA3;CID3 =DCPI(180) RC180 = degree of circularity
 and normal coordinates:
 Incident light (cm**-1):   19436.35
                      1                      2                      3
                      A                      A                      A
 Frequencies --     60.1483                80.2874                98.5269
 Red. masses --      9.4010                11.0952                10.0636
 Frc consts  --      0.0200                 0.0421                 0.0576
 IR Inten    --      1.4532                 0.3799                 4.5348
 RamAct Fr= 1--      1.2593                 0.8637                 0.5329
  Dep-P Fr= 1--      0.7479                 0.7088                 0.7500
  Dep-U Fr= 1--      0.8558                 0.8296                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0006                 0.0000
 Beta2  Fr= 1--      0.1796                 0.1194                 0.0761
 AlphaG Fr= 1--      0.0014                 0.0009                -0.0000
 Gamma2 Fr= 1--     -0.1887                -0.0780                 0.0245
 Delta2 Fr= 1--     -0.0151                -0.0257                 0.0223
 Raman1 Fr= 1--       5.037                  3.455                  2.131
 ROA1   Fr= 1--     -18.601                 -8.313                  3.064
 CID1   Fr= 1--      -3.693                 -2.406                  1.438
 Raman2 Fr= 1--       2.155                  1.433                  0.913
 ROA2   Fr= 1--      -4.409                 -1.667                  0.410
 CID2   Fr= 1--      -2.046                 -1.163                  0.448
 Raman3 Fr= 1--       4.311                  2.866                  1.827
 ROA3   Fr= 1--     -18.601                 -8.313                  3.064
 CID3   Fr= 1--      -4.315                 -2.900                  1.677
 RC180  Fr= 1--       0.712                  0.659                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01  -0.08   0.04    -0.17  -0.07   0.05     0.04  -0.01  -0.05
     2   8    -0.19  -0.20   0.30    -0.23  -0.09   0.09     0.28   0.09  -0.22
     3   8     0.22  -0.02  -0.22    -0.32  -0.13   0.20    -0.26  -0.18   0.19
     4   6    -0.01  -0.00  -0.00     0.01   0.03  -0.11     0.00   0.05  -0.05
     5   6     0.01   0.00  -0.00    -0.01  -0.03  -0.11     0.00   0.05   0.05
     6   6     0.01   0.08   0.04     0.17   0.07   0.05     0.04  -0.01   0.05
     7   8     0.19   0.20   0.30     0.23   0.09   0.09     0.28   0.09   0.22
     8   8    -0.02  -0.01  -0.09     0.05   0.04  -0.24    -0.03   0.05  -0.14
     9   8     0.02   0.01  -0.09    -0.05  -0.04  -0.24    -0.03   0.05   0.14
    10   8    -0.22   0.02  -0.22     0.32   0.13   0.20    -0.26  -0.18  -0.19
    11   1     0.01   0.04   0.02     0.04   0.15  -0.03    -0.04   0.10  -0.05
    12   1    -0.01  -0.04   0.02    -0.04  -0.15  -0.03    -0.04   0.10   0.05
    13   1    -0.30  -0.03  -0.33     0.21   0.09   0.10    -0.33  -0.18  -0.19
    14   1     0.30   0.03  -0.33    -0.21  -0.09   0.10    -0.33  -0.18   0.19
    15   1     0.12   0.01   0.08     0.10  -0.02  -0.23     0.02   0.06  -0.07
    16   1    -0.12  -0.01   0.08    -0.10   0.02  -0.23     0.02   0.06   0.07
                      4                      5                      6
                      A                      A                      A
 Frequencies --    235.6803               258.0366               313.1501
 Red. masses --      7.0100                 7.0185                 6.1835
 Frc consts  --      0.2294                 0.2753                 0.3573
 IR Inten    --      1.1777                45.7005                27.4254
 RamAct Fr= 1--      0.5464                 0.0173                 0.8609
  Dep-P Fr= 1--      0.2444                 0.7500                 0.1335
  Dep-U Fr= 1--      0.3928                 0.8571                 0.2355
 Alpha2 Fr= 1--      0.0066                 0.0000                 0.0139
 Beta2  Fr= 1--      0.0358                 0.0025                 0.0338
 AlphaG Fr= 1--     -0.0103                -0.0000                -0.0036
 Gamma2 Fr= 1--     -0.1974                 0.1049                 0.2637
 Delta2 Fr= 1--     -0.1444                 0.0043                 0.1583
 Raman1 Fr= 1--       2.186                  0.069                  3.444
 ROA1   Fr= 1--     -23.576                 10.212                 30.385
 CID1   Fr= 1--     -10.786                147.717                  8.823
 Raman2 Fr= 1--       0.429                  0.030                  0.406
 ROA2   Fr= 1--      -3.583                  2.484                  5.064
 CID2   Fr= 1--      -8.347                 83.842                 12.485
 Raman3 Fr= 1--       0.859                  0.059                  0.811
 ROA3   Fr= 1--     -23.576                 10.212                 30.385
 CID3   Fr= 1--     -27.461                172.338                 37.457
 RC180  Fr= 1--      -0.214                  0.714                 -0.529
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.11   0.01   0.09     0.04   0.02   0.07     0.03  -0.08   0.05
     2   8     0.23   0.04   0.06     0.19   0.03   0.13    -0.04  -0.05  -0.11
     3   8     0.09  -0.08   0.04     0.03  -0.14  -0.08     0.15   0.15   0.19
     4   6     0.02   0.11   0.08    -0.04   0.07   0.08     0.00  -0.09   0.07
     5   6    -0.02  -0.11   0.08    -0.04   0.07  -0.08    -0.00   0.09   0.07
     6   6    -0.11  -0.01   0.09     0.04   0.02  -0.07    -0.03   0.08   0.05
     7   8    -0.23  -0.04   0.06     0.19   0.03  -0.13     0.04   0.05  -0.11
     8   8     0.18   0.14  -0.22    -0.19   0.04   0.26    -0.12  -0.09  -0.18
     9   8    -0.18  -0.14  -0.22    -0.19   0.04  -0.26     0.12   0.09  -0.18
    10   8    -0.09   0.08   0.04     0.03  -0.14   0.08    -0.15  -0.15   0.19
    11   1    -0.09   0.30   0.12     0.06  -0.06   0.07    -0.00  -0.00   0.11
    12   1     0.09  -0.30   0.12     0.06  -0.06  -0.07     0.00   0.00   0.11
    13   1    -0.07   0.04  -0.03    -0.21  -0.12   0.12    -0.36  -0.07   0.37
    14   1     0.07  -0.04  -0.03    -0.21  -0.12  -0.12     0.36   0.07   0.37
    15   1     0.26  -0.08  -0.31    -0.28   0.20   0.30    -0.08  -0.10  -0.15
    16   1    -0.26   0.08  -0.31    -0.28   0.20  -0.30     0.08   0.10  -0.15
                      7                      8                      9
                      A                      A                      A
 Frequencies --    316.8206               383.7256               436.0389
 Red. masses --      6.5230                 9.9559                 6.7727
 Frc consts  --      0.3858                 0.8637                 0.7587
 IR Inten    --     17.3903                 0.5802                31.4800
 RamAct Fr= 1--      0.0499                 2.1761                 0.9536
  Dep-P Fr= 1--      0.7500                 0.7327                 0.7500
  Dep-U Fr= 1--      0.8571                 0.8457                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0006                 0.0000
 Beta2  Fr= 1--      0.0071                 0.3067                 0.1362
 AlphaG Fr= 1--      0.0000                -0.0042                -0.0000
 Gamma2 Fr= 1--     -0.0265                -0.1644                 1.0979
 Delta2 Fr= 1--     -0.0231                -0.2364                 0.4511
 Raman1 Fr= 1--       0.200                  8.704                  3.814
 ROA1   Fr= 1--      -3.280                -23.344                119.832
 CID1   Fr= 1--     -16.422                 -2.682                 31.416
 Raman2 Fr= 1--       0.086                  3.681                  1.635
 ROA2   Fr= 1--      -0.450                 -2.054                 22.740
 CID2   Fr= 1--      -5.257                 -0.558                 13.911
 Raman3 Fr= 1--       0.171                  7.361                  3.269
 ROA3   Fr= 1--      -3.280                -23.344                119.832
 CID3   Fr= 1--     -19.160                 -3.171                 36.652
 RC180  Fr= 1--       0.714                  0.691                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.06   0.05  -0.08     0.05  -0.18  -0.05     0.17   0.02  -0.19
     2   8    -0.02   0.03   0.03    -0.09  -0.18  -0.18    -0.17  -0.11  -0.03
     3   8    -0.16  -0.11  -0.17     0.08  -0.09   0.06    -0.05  -0.07   0.04
     4   6    -0.05   0.01  -0.05     0.07  -0.10   0.02     0.24   0.12  -0.18
     5   6    -0.05   0.01   0.05    -0.07   0.10   0.02     0.24   0.12   0.18
     6   6    -0.06   0.05   0.08    -0.05   0.18  -0.05     0.17   0.02   0.19
     7   8    -0.02   0.03  -0.03     0.09   0.18  -0.18    -0.17  -0.11   0.03
     8   8     0.29   0.04   0.13     0.37  -0.09   0.14    -0.08   0.07   0.09
     9   8     0.29   0.04  -0.13    -0.37   0.09   0.14    -0.08   0.07  -0.09
    10   8    -0.16  -0.11   0.17    -0.08   0.09   0.06    -0.05  -0.07  -0.04
    11   1    -0.18  -0.01  -0.11     0.04  -0.12  -0.01     0.13  -0.07  -0.32
    12   1    -0.18  -0.01   0.11    -0.04   0.12  -0.01     0.13  -0.07   0.32
    13   1    -0.30  -0.04   0.33    -0.15   0.10   0.07     0.03  -0.03   0.06
    14   1    -0.30  -0.04  -0.33     0.15  -0.10   0.07     0.03  -0.03  -0.06
    15   1     0.24  -0.06  -0.01     0.33  -0.16   0.01    -0.16   0.28   0.17
    16   1     0.24  -0.06   0.01    -0.33   0.16   0.01    -0.16   0.28  -0.17
                     10                     11                     12
                      A                      A                      A
 Frequencies --    523.9481               540.3329               588.7258
 Red. masses --      4.9972                 7.8581                 6.2214
 Frc consts  --      0.8083                 1.3517                 1.2705
 IR Inten    --      9.0176                 1.6826                 0.3915
 RamAct Fr= 1--      3.4183                 2.2488                 4.7595
  Dep-P Fr= 1--      0.0901                 0.7500                 0.3080
  Dep-U Fr= 1--      0.1653                 0.8571                 0.4709
 Alpha2 Fr= 1--      0.0613                 0.0000                 0.0477
 Beta2  Fr= 1--      0.0942                 0.3213                 0.3736
 AlphaG Fr= 1--     -0.0306                -0.0000                 0.0657
 Gamma2 Fr= 1--      0.6064                -0.9669                -0.2918
 Delta2 Fr= 1--      0.3512                 0.1301                -0.8728
 Raman1 Fr= 1--      13.673                  8.995                 19.038
 ROA1   Fr= 1--      69.451                -88.659                -55.938
 CID1   Fr= 1--       5.079                 -9.856                 -2.938
 Raman2 Fr= 1--       1.130                  3.855                  4.483
 ROA2   Fr= 1--      11.744                -24.246                 -0.020
 CID2   Fr= 1--      10.391                 -6.289                 -0.004
 Raman3 Fr= 1--       2.260                  7.710                  8.966
 ROA3   Fr= 1--      69.451                -88.659                -55.938
 CID3   Fr= 1--      30.725                -11.499                 -6.239
 RC180  Fr= 1--      -0.669                  0.714                 -0.058
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.12  -0.05   0.14    -0.08  -0.18   0.13    -0.12   0.05   0.07
     2   8    -0.09   0.05  -0.15    -0.10  -0.08  -0.26     0.08   0.11   0.09
     3   8     0.01  -0.07  -0.12     0.12  -0.10  -0.01    -0.07   0.05  -0.08
     4   6    -0.07   0.02   0.25    -0.03   0.13   0.16    -0.02  -0.16   0.04
     5   6     0.07  -0.02   0.25    -0.03   0.13  -0.16     0.02   0.16   0.04
     6   6     0.12   0.05   0.14    -0.08  -0.18  -0.13     0.12  -0.05   0.07
     7   8     0.09  -0.05  -0.15    -0.10  -0.08   0.26    -0.08  -0.11   0.09
     8   8    -0.03   0.05  -0.02     0.05   0.21   0.07     0.11  -0.28  -0.08
     9   8     0.03  -0.05  -0.02     0.05   0.21  -0.07    -0.11   0.28  -0.08
    10   8    -0.01   0.07  -0.12     0.12  -0.10   0.01     0.07  -0.05  -0.08
    11   1    -0.06   0.20   0.33     0.18   0.28   0.33     0.15  -0.25   0.08
    12   1     0.06  -0.20   0.33     0.18   0.28  -0.33    -0.15   0.25   0.08
    13   1     0.28   0.08  -0.12    -0.00  -0.12  -0.02     0.12  -0.05  -0.07
    14   1    -0.28  -0.08  -0.12    -0.00  -0.12   0.02    -0.12   0.05  -0.07
    15   1    -0.12  -0.10  -0.25     0.09   0.06  -0.01     0.16  -0.40  -0.12
    16   1     0.12   0.10  -0.25     0.09   0.06   0.01    -0.16   0.40  -0.12
                     13                     14                     15
                      A                      A                      A
 Frequencies --    616.0253               674.3790               684.6102
 Red. masses --      3.7552                 1.1527                 1.1051
 Frc consts  --      0.8396                 0.3089                 0.3052
 IR Inten    --      4.0828                 4.1135               182.2890
 RamAct Fr= 1--      1.1647                 0.6993                 0.1973
  Dep-P Fr= 1--      0.7500                 0.6404                 0.7500
  Dep-U Fr= 1--      0.8571                 0.7808                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0014                 0.0000
 Beta2  Fr= 1--      0.1664                 0.0910                 0.0282
 AlphaG Fr= 1--      0.0000                 0.0265                 0.0000
 Gamma2 Fr= 1--      1.2938                -0.5581                -0.0736
 Delta2 Fr= 1--      0.4690                -0.0637                 0.1380
 Raman1 Fr= 1--       4.659                  2.797                  0.789
 ROA1   Fr= 1--     139.209                -55.612                 -2.653
 CID1   Fr= 1--      29.881                -19.880                 -3.362
 Raman2 Fr= 1--       1.997                  1.092                  0.338
 ROA2   Fr= 1--      27.298                -12.884                 -2.871
 CID2   Fr= 1--      13.672                -11.799                 -8.489
 Raman3 Fr= 1--       3.993                  2.184                  0.676
 ROA3   Fr= 1--     139.209                -55.612                 -2.653
 CID3   Fr= 1--      34.861                -25.463                 -3.922
 RC180  Fr= 1--       0.714                  0.562                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.01   0.07   0.10     0.00   0.01  -0.00    -0.01   0.01   0.02
     2   8    -0.07   0.12  -0.04    -0.00   0.01  -0.03    -0.01   0.02  -0.00
     3   8    -0.02  -0.07  -0.10    -0.03  -0.03   0.01    -0.02  -0.02   0.00
     4   6     0.19  -0.01   0.08    -0.01  -0.01   0.04     0.01  -0.01   0.02
     5   6     0.19  -0.01  -0.08     0.01   0.01   0.04     0.01  -0.01  -0.02
     6   6    -0.01   0.07  -0.10    -0.00  -0.01  -0.00    -0.01   0.01  -0.02
     7   8    -0.07   0.12   0.04     0.00  -0.01  -0.03    -0.01   0.02   0.00
     8   8    -0.03  -0.10  -0.06    -0.02  -0.00  -0.02    -0.01  -0.01  -0.03
     9   8    -0.03  -0.10   0.06     0.02   0.00  -0.02    -0.01  -0.01   0.03
    10   8    -0.02  -0.07   0.10     0.03   0.03   0.01    -0.02  -0.02  -0.00
    11   1     0.37  -0.01   0.17    -0.05  -0.01   0.02     0.05  -0.03   0.02
    12   1     0.37  -0.01  -0.17     0.04   0.01   0.02     0.05  -0.03  -0.02
    13   1    -0.37  -0.06   0.13    -0.32  -0.13  -0.33     0.30   0.13   0.33
    14   1    -0.37  -0.06  -0.13     0.31   0.13  -0.33     0.31   0.14  -0.34
    15   1    -0.18  -0.03  -0.19     0.29   0.04   0.42     0.29   0.07   0.43
    16   1    -0.18  -0.03   0.19    -0.30  -0.04   0.42     0.28   0.07  -0.43
                     16                     17                     18
                      A                      A                      A
 Frequencies --    731.6679               806.7160               816.6370
 Red. masses --      6.9600                 6.1376                 5.2323
 Frc consts  --      2.1953                 2.3534                 2.0559
 IR Inten    --      0.2850                 5.7443                 1.0486
 RamAct Fr= 1--      3.4880                 1.6882                 7.5012
  Dep-P Fr= 1--      0.0452                 0.7500                 0.0357
  Dep-U Fr= 1--      0.0864                 0.8571                 0.0689
 Alpha2 Fr= 1--      0.0697                 0.0000                 0.1533
 Beta2  Fr= 1--      0.0502                 0.2412                 0.0862
 AlphaG Fr= 1--      0.0081                 0.0000                 0.1045
 Gamma2 Fr= 1--      0.8683                -1.0878                 0.2170
 Delta2 Fr= 1--     -0.0514                -0.6692                -0.0296
 Raman1 Fr= 1--      13.952                  6.753                 30.005
 ROA1   Fr= 1--      81.709               -125.839                 19.887
 CID1   Fr= 1--       5.856                -18.635                  0.663
 Raman2 Fr= 1--       0.603                  2.894                  1.034
 ROA2   Fr= 1--      21.249                -20.753                  5.445
 CID2   Fr= 1--      35.253                 -7.171                  5.267
 Raman3 Fr= 1--       1.206                  5.788                  2.068
 ROA3   Fr= 1--      81.709               -125.839                 19.887
 CID3   Fr= 1--      67.779                -21.741                  9.618
 RC180  Fr= 1--      -0.827                  0.714                 -0.862
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.32   0.20  -0.07     0.22   0.14   0.04    -0.08   0.00   0.24
     2   8    -0.18   0.11   0.02    -0.14   0.12  -0.01    -0.03   0.13  -0.06
     3   8     0.04  -0.15   0.04     0.13  -0.17   0.11     0.14  -0.11   0.04
     4   6     0.07  -0.01   0.08    -0.19  -0.03   0.00     0.09   0.02  -0.23
     5   6    -0.07   0.01   0.08    -0.19  -0.03  -0.00    -0.09  -0.02  -0.23
     6   6    -0.32  -0.20  -0.07     0.22   0.14  -0.04     0.08  -0.00   0.24
     7   8     0.18  -0.11   0.02    -0.14   0.12   0.01     0.03  -0.13  -0.06
     8   8    -0.01  -0.11  -0.05     0.02  -0.02  -0.01    -0.01  -0.02   0.02
     9   8     0.01   0.11  -0.05     0.02  -0.02   0.01     0.01   0.02   0.02
    10   8    -0.04   0.15   0.04     0.13  -0.17  -0.11    -0.14   0.11   0.04
    11   1    -0.20  -0.12  -0.10    -0.43  -0.07  -0.12     0.47  -0.04  -0.07
    12   1     0.20   0.12  -0.10    -0.43  -0.07   0.12    -0.47   0.04  -0.07
    13   1     0.37   0.09  -0.12    -0.17  -0.06   0.15     0.01  -0.01  -0.22
    14   1    -0.37  -0.09  -0.12    -0.17  -0.06  -0.15    -0.01   0.01  -0.22
    15   1    -0.11  -0.08  -0.15     0.08  -0.17  -0.06    -0.05   0.18   0.13
    16   1     0.11   0.08  -0.15     0.08  -0.17   0.06     0.05  -0.18   0.13
                     19                     20                     21
                      A                      A                      A
 Frequencies --    825.3659               832.5993               951.4980
 Red. masses --      1.0668                 1.0520                 5.9019
 Frc consts  --      0.4282                 0.4297                 3.1482
 IR Inten    --      5.9392               145.2044                44.2832
 RamAct Fr= 1--      0.5763                 0.0696                 0.2181
  Dep-P Fr= 1--      0.7500                 0.1339                 0.7500
  Dep-U Fr= 1--      0.8571                 0.2362                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0011                 0.0000
 Beta2  Fr= 1--      0.0823                 0.0027                 0.0312
 AlphaG Fr= 1--     -0.0000                -0.0147                -0.0000
 Gamma2 Fr= 1--      0.2710                 0.1197                 0.3733
 Delta2 Fr= 1--     -0.0394                 0.0356                 0.0263
 Raman1 Fr= 1--       2.305                  0.278                  0.872
 ROA1   Fr= 1--      24.752                 12.627                 36.681
 CID1   Fr= 1--      10.738                 45.357                 42.048
 Raman2 Fr= 1--       0.988                  0.033                  0.374
 ROA2   Fr= 1--       6.818                  2.588                  8.750
 CID2   Fr= 1--       6.901                 78.721                 23.404
 Raman3 Fr= 1--       1.976                  0.066                  0.748
 ROA3   Fr= 1--      24.752                 12.627                 36.681
 CID3   Fr= 1--      12.527                192.060                 49.056
 RC180  Fr= 1--       0.714                 -0.528                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.00  -0.00  -0.00    -0.00  -0.00  -0.00    -0.19  -0.05   0.21
     2   8     0.01   0.01  -0.01    -0.00  -0.00  -0.00     0.01   0.08  -0.03
     3   8    -0.02  -0.01   0.02     0.02   0.01  -0.02     0.10  -0.04   0.02
     4   6     0.00   0.00   0.01     0.00   0.00   0.00     0.04   0.00  -0.33
     5   6     0.00   0.00  -0.01    -0.00  -0.00   0.00     0.04   0.00   0.33
     6   6     0.00  -0.00   0.00     0.00   0.00  -0.00    -0.19  -0.05  -0.21
     7   8     0.01   0.01   0.01     0.00   0.00  -0.00     0.01   0.08   0.03
     8   8     0.00  -0.00   0.03    -0.00   0.00  -0.03     0.01  -0.02   0.03
     9   8     0.00  -0.00  -0.03     0.00  -0.00  -0.03     0.01  -0.02  -0.03
    10   8    -0.02  -0.01  -0.02    -0.02  -0.01  -0.02     0.10  -0.04  -0.02
    11   1    -0.00   0.02   0.01     0.02   0.00   0.01    -0.18   0.06  -0.40
    12   1    -0.00   0.02  -0.01    -0.02  -0.00   0.01    -0.18   0.06   0.40
    13   1     0.37   0.16   0.34     0.36   0.16   0.33    -0.01  -0.00   0.07
    14   1     0.36   0.15  -0.34    -0.36  -0.16   0.34    -0.01  -0.00  -0.07
    15   1    -0.27  -0.08  -0.38     0.27   0.07   0.39    -0.16   0.24   0.04
    16   1    -0.27  -0.08   0.39    -0.27  -0.07   0.39    -0.16   0.24  -0.04
                     22                     23                     24
                      A                      A                      A
 Frequencies --   1061.4013              1099.3324              1116.3428
 Red. masses --      3.2926                 7.1915                 2.6612
 Frc consts  --      2.1855                 5.1207                 1.9540
 IR Inten    --     15.4596               148.7553                 1.3768
 RamAct Fr= 1--      1.8646                 0.0727                 3.0895
  Dep-P Fr= 1--      0.6702                 0.7500                 0.4693
  Dep-U Fr= 1--      0.8025                 0.8571                 0.6388
 Alpha2 Fr= 1--      0.0026                 0.0000                 0.0175
 Beta2  Fr= 1--      0.2494                 0.0104                 0.3289
 AlphaG Fr= 1--      0.0132                 0.0000                -0.0033
 Gamma2 Fr= 1--     -0.0940                 0.0647                 0.0914
 Delta2 Fr= 1--      0.2276                 0.0708                 0.7667
 Raman1 Fr= 1--       7.458                  0.291                 12.358
 ROA1   Fr= 1--      -1.745                  8.475                 33.310
 CID1   Fr= 1--      -0.234                 29.128                  2.695
 Raman2 Fr= 1--       2.993                  0.125                  3.947
 ROA2   Fr= 1--      -4.078                  0.986                 -3.940
 CID2   Fr= 1--      -1.363                  7.909                 -0.998
 Raman3 Fr= 1--       5.985                  0.249                  7.894
 ROA3   Fr= 1--      -1.745                  8.475                 33.310
 CID3   Fr= 1--      -0.291                 33.983                  4.220
 RC180  Fr= 1--       0.605                  0.714                  0.278
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.05  -0.03   0.02     0.03  -0.03   0.01    -0.02  -0.02   0.03
     2   8     0.02  -0.05  -0.01     0.01  -0.05  -0.02     0.00  -0.01  -0.01
     3   8    -0.07   0.06  -0.05    -0.00   0.04   0.01     0.02   0.01   0.02
     4   6     0.25   0.10   0.06    -0.10   0.39   0.01    -0.09   0.19  -0.04
     5   6    -0.25  -0.10   0.06    -0.10   0.39  -0.01     0.09  -0.19  -0.04
     6   6    -0.05   0.03   0.02     0.03  -0.03  -0.01     0.02   0.02   0.03
     7   8    -0.02   0.05  -0.01     0.01  -0.05   0.02    -0.00   0.01  -0.01
     8   8    -0.01  -0.07  -0.02     0.05  -0.28   0.00     0.02  -0.14   0.01
     9   8     0.01   0.07  -0.02     0.06  -0.29  -0.00    -0.02   0.13   0.01
    10   8     0.07  -0.06  -0.05    -0.00   0.04  -0.01    -0.02  -0.01   0.02
    11   1     0.36   0.27   0.20    -0.04   0.44   0.07    -0.51   0.36  -0.15
    12   1    -0.36  -0.27   0.20    -0.04   0.44  -0.07     0.51  -0.36  -0.15
    13   1     0.02  -0.06  -0.06    -0.07   0.07   0.10     0.02  -0.02  -0.02
    14   1    -0.02   0.06  -0.06    -0.07   0.07  -0.10    -0.02   0.02  -0.02
    15   1    -0.20   0.32   0.08    -0.05   0.07   0.17    -0.07   0.09   0.09
    16   1     0.20  -0.32   0.08    -0.05   0.07  -0.17     0.07  -0.09   0.09
                     25                     26                     27
                      A                      A                      A
 Frequencies --   1229.7973              1234.4758              1263.7074
 Red. masses --      2.1232                 1.9832                 1.5577
 Frc consts  --      1.8919                 1.7807                 1.4656
 IR Inten    --     16.9145                 0.5649                 0.0004
 RamAct Fr= 1--      0.8361                15.0308                 2.1202
  Dep-P Fr= 1--      0.7500                 0.2266                 0.7049
  Dep-U Fr= 1--      0.8571                 0.3695                 0.8269
 Alpha2 Fr= 1--      0.0000                 0.1900                 0.0017
 Beta2  Fr= 1--      0.1194                 0.9257                 0.2922
 AlphaG Fr= 1--     -0.0000                -0.0274                 0.0105
 Gamma2 Fr= 1--     -1.0203                 4.6827                -0.1643
 Delta2 Fr= 1--     -1.6738                 2.8556                -1.5090
 Raman1 Fr= 1--       3.344                 60.123                  8.481
 ROA1   Fr= 1--    -151.516                540.917                -64.061
 CID1   Fr= 1--     -45.306                  8.997                 -7.554
 Raman2 Fr= 1--       1.433                 11.108                  3.506
 ROA2   Fr= 1--     -11.098                 89.539                  8.129
 CID2   Fr= 1--      -7.743                  8.061                  2.318
 Raman3 Fr= 1--       2.867                 22.216                  7.013
 ROA3   Fr= 1--    -151.516                540.917                -64.061
 CID3   Fr= 1--     -52.857                 24.348                 -9.135
 RC180  Fr= 1--       0.714                 -0.261                  0.654
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.11   0.03  -0.13     0.11  -0.02   0.09    -0.01  -0.03   0.06
     2   8    -0.01   0.07   0.03     0.01  -0.07  -0.02     0.01   0.01  -0.00
     3   8     0.04  -0.08   0.01    -0.03   0.07   0.01    -0.01   0.02  -0.02
     4   6     0.00   0.02   0.02    -0.07   0.01  -0.03     0.10  -0.09  -0.00
     5   6     0.00   0.02  -0.02     0.07  -0.01  -0.03    -0.10   0.09  -0.00
     6   6    -0.11   0.03   0.13    -0.11   0.02   0.09     0.01   0.03   0.06
     7   8    -0.01   0.07  -0.03    -0.01   0.07  -0.02    -0.01  -0.01  -0.00
     8   8     0.02  -0.02  -0.00    -0.00   0.01  -0.00     0.00   0.03  -0.01
     9   8     0.02  -0.02   0.00     0.00  -0.01  -0.00    -0.00  -0.03  -0.01
    10   8     0.04  -0.08  -0.01     0.03  -0.07   0.01     0.01  -0.02  -0.02
    11   1     0.09   0.13   0.11     0.14  -0.15  -0.00    -0.58  -0.04  -0.29
    12   1     0.09   0.13  -0.11    -0.14   0.15  -0.00     0.58   0.04  -0.29
    13   1     0.44  -0.23  -0.38     0.44  -0.23  -0.39     0.11  -0.04  -0.07
    14   1     0.44  -0.23   0.38    -0.44   0.23  -0.39    -0.11   0.04  -0.07
    15   1    -0.07   0.13   0.02     0.07  -0.09   0.00    -0.07   0.15   0.03
    16   1    -0.07   0.13  -0.02    -0.07   0.09   0.00     0.07  -0.15   0.03
                     28                     29                     30
                      A                      A                      A
 Frequencies --   1276.7484              1331.8815              1350.0539
 Red. masses --      1.1639                 1.4539                 1.3906
 Frc consts  --      1.1178                 1.5196                 1.4933
 IR Inten    --     35.6060                 0.0000               272.4235
 RamAct Fr= 1--      1.8432                 3.4841                 0.1062
  Dep-P Fr= 1--      0.7500                 0.7500                 0.7500
  Dep-U Fr= 1--      0.8571                 0.8571                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0000                 0.0000
 Beta2  Fr= 1--      0.2633                 0.4977                 0.0152
 AlphaG Fr= 1--     -0.0000                -0.0002                 0.0000
 Gamma2 Fr= 1--      1.3073                 0.4076                -0.2595
 Delta2 Fr= 1--      0.9002                 0.7719                -0.0775
 Raman1 Fr= 1--       7.373                 13.936                  0.425
 ROA1   Fr= 1--     154.310                 63.832                -27.392
 CID1   Fr= 1--      20.930                  4.580                -64.457
 Raman2 Fr= 1--       3.160                  5.973                  0.182
 ROA2   Fr= 1--      24.174                  3.608                 -5.608
 CID2   Fr= 1--       7.651                  0.604                -30.790
 Raman3 Fr= 1--       6.319                 11.945                  0.364
 ROA3   Fr= 1--     154.310                 63.832                -27.392
 CID3   Fr= 1--      24.418                  5.344                -75.199
 RC180  Fr= 1--       0.714                  0.714                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.02   0.01   0.01     0.03  -0.00  -0.01    -0.03   0.02  -0.06
     2   8    -0.00  -0.01  -0.00    -0.00   0.01   0.01     0.01  -0.01   0.01
     3   8    -0.01   0.01  -0.01    -0.00   0.00   0.00     0.04  -0.00   0.04
     4   6     0.03  -0.07   0.02    -0.06  -0.12  -0.04    -0.05  -0.04  -0.05
     5   6     0.03  -0.07  -0.02     0.06   0.12  -0.04    -0.05  -0.04   0.05
     6   6     0.02   0.01  -0.01    -0.03   0.00  -0.01    -0.03   0.02   0.06
     7   8    -0.00  -0.01   0.00     0.00  -0.01   0.01     0.01  -0.01  -0.01
     8   8     0.01  -0.01   0.00     0.02  -0.00   0.00     0.01   0.00   0.00
     9   8     0.01  -0.01  -0.00    -0.02   0.00   0.00     0.01   0.00  -0.00
    10   8    -0.01   0.01   0.01     0.00  -0.00   0.00     0.04  -0.00  -0.04
    11   1    -0.33   0.51   0.12     0.00   0.55   0.29     0.45   0.18   0.28
    12   1    -0.33   0.51  -0.12    -0.00  -0.55   0.29     0.45   0.18  -0.28
    13   1    -0.03   0.02   0.02     0.06  -0.03  -0.06    -0.28   0.13   0.25
    14   1    -0.03   0.02  -0.02    -0.06   0.03  -0.06    -0.28   0.13  -0.25
    15   1    -0.14   0.29   0.08    -0.13   0.26   0.07    -0.04   0.08   0.02
    16   1    -0.14   0.29  -0.08     0.13  -0.26   0.07    -0.04   0.08  -0.02
                     31                     32                     33
                      A                      A                      A
 Frequencies --   1395.0249              1400.8768              1464.7035
 Red. masses --      1.9049                 2.2973                 1.2431
 Frc consts  --      2.1841                 2.6562                 1.5713
 IR Inten    --    575.6193               231.6057                63.2067
 RamAct Fr= 1--      0.2100                 1.2058                 4.1016
  Dep-P Fr= 1--      0.7500                 0.6493                 0.7500
  Dep-U Fr= 1--      0.8571                 0.7874                 0.8571
 Alpha2 Fr= 1--      0.0000                 0.0022                 0.0000
 Beta2  Fr= 1--      0.0300                 0.1582                 0.5859
 AlphaG Fr= 1--      0.0000                 0.0097                -0.0000
 Gamma2 Fr= 1--      0.1458                -1.4988                -3.0693
 Delta2 Fr= 1--     -0.0019                -0.2687                -1.1328
 Raman1 Fr= 1--       0.840                  4.823                 16.406
 ROA1   Fr= 1--      13.934               -152.488               -330.900
 CID1   Fr= 1--      16.587                -31.616                -20.169
 Raman2 Fr= 1--       0.360                  1.899                  7.031
 ROA2   Fr= 1--       3.513                -33.823                -64.601
 CID2   Fr= 1--       9.759                -17.813                 -9.188
 Raman3 Fr= 1--       0.720                  3.798                 14.062
 ROA3   Fr= 1--      13.934               -152.488               -330.900
 CID3   Fr= 1--      19.352                -40.154                -23.531
 RC180  Fr= 1--       0.714                  0.575                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6     0.11  -0.02   0.07    -0.13   0.04  -0.12     0.04   0.00   0.04
     2   8    -0.02   0.03  -0.00     0.02  -0.03   0.01    -0.01  -0.01  -0.01
     3   8    -0.06   0.01  -0.05     0.08  -0.01   0.08    -0.02   0.01  -0.02
     4   6    -0.05  -0.02  -0.09     0.07   0.00   0.03    -0.06  -0.01   0.01
     5   6    -0.05  -0.02   0.09    -0.07  -0.00   0.03    -0.06  -0.01  -0.01
     6   6     0.11  -0.02  -0.07     0.13  -0.04  -0.12     0.04   0.00  -0.03
     7   8    -0.02   0.03   0.00    -0.02   0.03   0.01    -0.01  -0.01   0.01
     8   8    -0.01   0.00   0.02    -0.02  -0.00   0.01     0.04  -0.00  -0.03
     9   8    -0.01   0.00  -0.02     0.02   0.00   0.00     0.04  -0.00   0.03
    10   8    -0.06   0.01   0.05    -0.08   0.01   0.08    -0.02   0.01   0.02
    11   1     0.33   0.28   0.22    -0.02   0.13   0.04     0.16  -0.30  -0.01
    12   1     0.33   0.28  -0.22     0.02  -0.13   0.04     0.17  -0.31   0.01
    13   1     0.30  -0.13  -0.27     0.45  -0.20  -0.40     0.08  -0.03  -0.06
    14   1     0.30  -0.13   0.27    -0.45   0.20  -0.40     0.08  -0.03   0.06
    15   1     0.11  -0.20  -0.01     0.05  -0.14  -0.03    -0.26   0.53   0.05
    16   1     0.11  -0.20   0.01    -0.05   0.14  -0.03    -0.27   0.54  -0.05
                     34                     35                     36
                      A                      A                      A
 Frequencies --   1467.7897              1796.1372              1806.3201
 Red. masses --      1.2471                 8.9196                 8.8299
 Frc consts  --      1.5830                16.9542                16.9744
 IR Inten    --      0.1891                29.7083               422.7918
 RamAct Fr= 1--      3.1164                22.4149                 1.8593
  Dep-P Fr= 1--      0.5496                 0.1051                 0.7500
  Dep-U Fr= 1--      0.7093                 0.1902                 0.8571
 Alpha2 Fr= 1--      0.0119                 0.3876                 0.0000
 Beta2  Fr= 1--      0.3684                 0.7105                 0.2656
 AlphaG Fr= 1--     -0.0072                -0.2960                -0.0000
 Gamma2 Fr= 1--     -0.5527                -3.7183                 2.2027
 Delta2 Fr= 1--      0.5251                -2.4102                 2.7513
 Raman1 Fr= 1--      12.465                 89.659                  7.437
 ROA1   Fr= 1--     -36.257               -434.083                299.499
 CID1   Fr= 1--      -2.909                 -4.841                 40.271
 Raman2 Fr= 1--       4.421                  8.526                  3.187
 ROA2   Fr= 1--     -17.466                -69.957                 30.853
 CID2   Fr= 1--      -3.950                 -8.205                  9.680
 Raman3 Fr= 1--       8.842                 17.053                  6.375
 ROA3   Fr= 1--     -36.257               -434.083                299.499
 CID3   Fr= 1--      -4.100                -25.455                 46.983
 RC180  Fr= 1--       0.419                 -0.620                  0.714
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.02  -0.00  -0.03     0.09  -0.46  -0.14    -0.10   0.46   0.13
     2   8     0.01   0.01   0.01    -0.05   0.27   0.09     0.05  -0.27  -0.09
     3   8     0.02  -0.00   0.02     0.00   0.04   0.02     0.00  -0.05  -0.02
     4   6    -0.05   0.01   0.04     0.00   0.05   0.01    -0.00  -0.00  -0.03
     5   6     0.05  -0.01   0.04    -0.00  -0.05   0.01    -0.00  -0.00   0.03
     6   6     0.03   0.00  -0.03    -0.09   0.46  -0.14    -0.10   0.46  -0.13
     7   8    -0.01  -0.01   0.01     0.05  -0.27   0.09     0.05  -0.27   0.09
     8   8     0.04  -0.01  -0.03    -0.00   0.01   0.00    -0.00  -0.01   0.00
     9   8    -0.04   0.01  -0.03     0.00  -0.01   0.00    -0.00  -0.01  -0.00
    10   8    -0.02   0.00   0.02    -0.00  -0.04   0.02     0.00  -0.05   0.02
    11   1     0.08  -0.34  -0.05     0.06  -0.05  -0.02     0.07   0.04   0.02
    12   1    -0.08   0.34  -0.05    -0.06   0.05  -0.02     0.07   0.04  -0.02
    13   1     0.06  -0.03  -0.06     0.24  -0.09  -0.24     0.27  -0.10  -0.23
    14   1    -0.06   0.02  -0.06    -0.24   0.09  -0.24     0.27  -0.10   0.23
    15   1    -0.26   0.54   0.07     0.05  -0.21   0.01     0.03  -0.18  -0.02
    16   1     0.26  -0.53   0.06    -0.05   0.21   0.01     0.03  -0.18   0.02
                     37                     38                     39
                      A                      A                      A
 Frequencies --   3048.6905              3056.0142              3493.6054
 Red. masses --      1.0833                 1.0845                 1.0667
 Frc consts  --      5.9325                 5.9677                 7.6709
 IR Inten    --     17.9182                 2.3303                95.0628
 RamAct Fr= 1--     40.0942               145.0132                99.0249
  Dep-P Fr= 1--      0.7500                 0.0936                 0.0392
  Dep-U Fr= 1--      0.8571                 0.1712                 0.0754
 Alpha2 Fr= 1--      0.0000                 2.5790                 2.0070
 Beta2  Fr= 1--      5.7277                 4.1370                 1.2443
 AlphaG Fr= 1--     -0.0000                -0.3511                 1.0130
 Gamma2 Fr= 1--      3.4390                -7.9212                37.6933
 Delta2 Fr= 1--      5.8734                -5.6700                 9.7978
 Raman1 Fr= 1--     160.377                580.053                396.099
 ROA1   Fr= 1--     518.088               -941.872               3932.083
 CID1   Fr= 1--       3.230                 -1.624                  9.927
 Raman2 Fr= 1--      68.733                 49.644                 14.931
 ROA2   Fr= 1--      35.548               -144.748                826.256
 CID2   Fr= 1--       0.517                 -2.916                 55.338
 Raman3 Fr= 1--     137.465                 99.288                 29.862
 ROA3   Fr= 1--     518.088               -941.872               3932.083
 CID3   Fr= 1--       3.769                 -9.486                131.675
 RC180  Fr= 1--       0.714                 -0.658                 -0.849
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00  -0.00     0.00  -0.00  -0.00     0.00  -0.01  -0.00
     2   8     0.00  -0.00   0.00    -0.00   0.00   0.00    -0.00   0.00   0.00
     3   8     0.00   0.00   0.00     0.00   0.00   0.00    -0.00  -0.01  -0.00
     4   6     0.02   0.02  -0.05     0.02   0.02  -0.05    -0.00  -0.00   0.00
     5   6     0.02   0.02   0.05    -0.02  -0.02  -0.05     0.00   0.00   0.00
     6   6    -0.00   0.00   0.00    -0.00   0.00  -0.00    -0.00   0.01  -0.00
     7   8     0.00  -0.00  -0.00     0.00  -0.00   0.00     0.00  -0.00   0.00
     8   8    -0.00   0.00   0.00    -0.00   0.00   0.00    -0.03  -0.02   0.02
     9   8    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.03   0.02   0.02
    10   8     0.00   0.00  -0.00    -0.00  -0.00   0.00     0.00   0.01  -0.00
    11   1    -0.27  -0.27   0.59    -0.27  -0.27   0.59     0.01   0.01  -0.01
    12   1    -0.27  -0.27  -0.59     0.27   0.27   0.59    -0.01  -0.01  -0.01
    13   1     0.00  -0.00   0.00    -0.00   0.00  -0.00     0.01  -0.13   0.05
    14   1     0.00  -0.00  -0.00     0.00  -0.00  -0.00    -0.01   0.13   0.05
    15   1     0.02   0.00  -0.01     0.01   0.00  -0.02     0.48   0.34  -0.37
    16   1     0.02   0.00   0.01    -0.01  -0.01  -0.02    -0.47  -0.33  -0.37
                     40                     41                     42
                      A                      A                      A
 Frequencies --   3503.5680              3578.6925              3580.9456
 Red. masses --      1.0673                 1.0641                 1.0642
 Frc consts  --      7.7190                 8.0292                 8.0404
 IR Inten    --    494.0138               228.0157                86.2749
 RamAct Fr= 1--     12.1372                 7.3174                49.5749
  Dep-P Fr= 1--      0.7495                 0.7498                 0.0803
  Dep-U Fr= 1--      0.8568                 0.8570                 0.1487
 Alpha2 Fr= 1--      0.0001                 0.0000                 0.9105
 Beta2  Fr= 1--      1.7332                 1.0452                 1.2288
 AlphaG Fr= 1--      0.0001                 0.0000                 0.0381
 Gamma2 Fr= 1--    -29.2892                 4.2261                -0.5876
 Delta2 Fr= 1--     -6.0689                 1.8650                -4.0306
 Raman1 Fr= 1--      48.549                 29.269                198.299
 ROA1   Fr= 1--   -3005.968                465.387               -185.387
 CID1   Fr= 1--     -61.916                 15.900                 -0.935
 Raman2 Fr= 1--      20.798                 12.542                 14.746
 ROA2   Fr= 1--    -654.389                 86.507                 18.142
 CID2   Fr= 1--     -31.464                  6.897                  1.230
 Raman3 Fr= 1--      41.596                 25.085                 29.492
 ROA3   Fr= 1--   -3005.968                465.387               -185.387
 CID3   Fr= 1--     -72.266                 18.553                 -6.286
 RC180  Fr= 1--       0.714                  0.714                 -0.703
  Atom  AN      X      Y      Z        X      Y      Z        X      Y      Z
     1   6    -0.00   0.00   0.00     0.00  -0.00  -0.00    -0.00   0.00  -0.00
     2   8     0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00  -0.00   0.00
     3   8     0.00  -0.00  -0.00    -0.00  -0.04  -0.02     0.00   0.04   0.02
     4   6    -0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00  -0.00   0.00
     5   6    -0.00  -0.00  -0.00    -0.00   0.00   0.00     0.00   0.00   0.00
     6   6    -0.00   0.00  -0.00     0.00  -0.00   0.00     0.00  -0.00  -0.00
     7   8     0.00  -0.00   0.00    -0.00   0.00  -0.00    -0.00   0.00   0.00
     8   8    -0.03  -0.02   0.02     0.00   0.00  -0.00    -0.01  -0.00   0.00
     9   8    -0.03  -0.02  -0.02     0.00   0.00   0.00     0.01   0.00   0.00
    10   8     0.00  -0.00   0.00    -0.00  -0.04   0.02    -0.00  -0.04   0.02
    11   1     0.01   0.01  -0.01    -0.00  -0.00   0.00     0.00   0.00  -0.00
    12   1     0.01   0.01   0.01    -0.00  -0.00  -0.00    -0.00  -0.00  -0.00
    13   1    -0.00   0.05  -0.02    -0.01   0.64  -0.28    -0.01   0.64  -0.28
    14   1    -0.00   0.05   0.02    -0.01   0.65   0.28     0.01  -0.63  -0.28
    15   1     0.49   0.33  -0.37    -0.04  -0.03   0.03     0.10   0.07  -0.08
    16   1     0.49   0.34   0.38    -0.04  -0.02  -0.03    -0.10  -0.07  -0.08

 -------------------
 - Thermochemistry -
 -------------------
 Temperature   298.150 Kelvin.  Pressure   1.00000 Atm.
 Atom     1 has atomic number  6 and mass  12.00000
 Atom     2 has atomic number  8 and mass  15.99491
 Atom     3 has atomic number  8 and mass  15.99491
 Atom     4 has atomic number  6 and mass  12.00000
 Atom     5 has atomic number  6 and mass  12.00000
 Atom     6 has atomic number  6 and mass  12.00000
 Atom     7 has atomic number  8 and mass  15.99491
 Atom     8 has atomic number  8 and mass  15.99491
 Atom     9 has atomic number  8 and mass  15.99491
 Atom    10 has atomic number  8 and mass  15.99491
 Atom    11 has atomic number  1 and mass   1.00783
 Atom    12 has atomic number  1 and mass   1.00783
 Atom    13 has atomic number  1 and mass   1.00783
 Atom    14 has atomic number  1 and mass   1.00783
 Atom    15 has atomic number  1 and mass   1.00783
 Atom    16 has atomic number  1 and mass   1.00783
 Molecular mass:   150.01644 amu.
 Principal axes and moments of inertia in atomic units:
                           1         2         3
     Eigenvalues --   987.111891545.354791868.90457
           X            0.99932  -0.03687  -0.00000
           Y            0.03687   0.99932  -0.00000
           Z            0.00000   0.00000   1.00000
 This molecule is an asymmetric top.
 Rotational symmetry number  1.
 Warning -- assumption of classical behavior for rotation
           may cause significant error
 Rotational temperatures (Kelvin)      0.08774     0.05605     0.04634
 Rotational constants (GHZ):           1.82830     1.16785     0.96567
 Zero-point vibrational energy     307027.7 (Joules/Mol)
                                   73.38139 (Kcal/Mol)
 Warning -- explicit consideration of  13 degrees of freedom as
           vibrations may cause significant error
 Vibrational temperatures:     86.54   115.52   141.76   339.09   371.26
          (Kelvin)            450.55   455.83   552.10   627.36   753.84
                              777.42   847.05   886.32   970.28   985.00
                             1052.71  1160.68  1174.96  1187.52  1197.92
                             1368.99  1527.12  1581.69  1606.17  1769.40
                             1776.14  1818.19  1836.96  1916.28  1942.43
                             2007.13  2015.55  2107.38  2111.82  2584.24
                             2598.89  4386.39  4396.92  5026.52  5040.85
                             5148.94  5152.18
 
 Zero-point correction=                           0.116941 (Hartree/Particle)
 Thermal correction to Energy=                    0.126064
 Thermal correction to Enthalpy=                  0.127008
 Thermal correction to Gibbs Free Energy=         0.082088
 Sum of electronic and zero-point Energies=           -607.578178
 Sum of electronic and thermal Energies=              -607.569055
 Sum of electronic and thermal Enthalpies=            -607.568111
 Sum of electronic and thermal Free Energies=         -607.613031
 
                     E (Thermal)             CV                S
                      KCal/Mol        Cal/Mol-Kelvin    Cal/Mol-Kelvin
 Total                   79.106             33.643             94.542
 Electronic               0.000              0.000              0.000
 Translational            0.889              2.981             40.927
 Rotational               0.889              2.981             29.435
 Vibrational             77.329             27.681             24.180
 Vibration     1          0.597              1.973              4.452
 Vibration     2          0.600              1.963              3.884
 Vibration     3          0.604              1.950              3.483
 Vibration     4          0.655              1.786              1.835
 Vibration     5          0.667              1.749              1.675
 Vibration     6          0.701              1.649              1.346
 Vibration     7          0.704              1.641              1.326
 Vibration     8          0.753              1.505              1.024
 Vibration     9          0.796              1.392              0.839
 Vibration    10          0.879              1.197              0.601
 Vibration    11          0.895              1.161              0.565
 Vibration    12          0.946              1.056              0.469
 Vibration    13          0.976              0.998              0.423
                       Q            Log10(Q)             Ln(Q)
 Total Bot       0.174628D-37        -37.757887        -86.940748
 Total V=0       0.107411D+17         16.031048         36.912853
 Vib (Bot)       0.400050D-51        -51.397886       -118.348005
 Vib (Bot)    1  0.343317D+01          0.535695          1.233483
 Vib (Bot)    2  0.256496D+01          0.409081          0.941944
 Vib (Bot)    3  0.208355D+01          0.318804          0.734072
 Vib (Bot)    4  0.833602D+00         -0.079041         -0.181999
 Vib (Bot)    5  0.753453D+00         -0.122944         -0.283089
 Vib (Bot)    6  0.602732D+00         -0.219875         -0.506282
 Vib (Bot)    7  0.594463D+00         -0.225875         -0.520097
 Vib (Bot)    8  0.469953D+00         -0.327946         -0.755123
 Vib (Bot)    9  0.397704D+00         -0.400440         -0.922046
 Vib (Bot)   10  0.306955D+00         -0.512925         -1.181054
 Vib (Bot)   11  0.293124D+00         -0.532948         -1.227158
 Vib (Bot)   12  0.256568D+00         -0.590798         -1.360362
 Vib (Bot)   13  0.238389D+00         -0.622714         -1.433853
 Vib (V=0)       0.246065D+03          2.391050          5.505596
 Vib (V=0)    1  0.396938D+01          0.598723          1.378611
 Vib (V=0)    2  0.311324D+01          0.493213          1.135665
 Vib (V=0)    3  0.264270D+01          0.422048          0.971802
 Vib (V=0)    4  0.147206D+01          0.167924          0.386660
 Vib (V=0)    5  0.140426D+01          0.147448          0.339512
 Vib (V=0)    6  0.128313D+01          0.108269          0.249299
 Vib (V=0)    7  0.127678D+01          0.106116          0.244341
 Vib (V=0)    8  0.118619D+01          0.074154          0.170746
 Vib (V=0)    9  0.113888D+01          0.056478          0.130046
 Vib (V=0)   10  0.108670D+01          0.036111          0.083149
 Vib (V=0)   11  0.107959D+01          0.033258          0.076579
 Vib (V=0)   12  0.106198D+01          0.026118          0.060140
 Vib (V=0)   13  0.105392D+01          0.022808          0.052518
 Electronic      0.100000D+01          0.000000          0.000000
 Translational   0.722208D+08          7.858662         18.095238
 Rotational      0.604417D+06          5.781336         13.312019
 
                                                          ROA calculations.
                                                             IR Spectrum
 
     33 33             33                                           11          1111111111   111                                     
     55 54             00                                           87          4443332222   100   9 8888  766 6555  4 333 22        
     87 09             54                                           09          6609537633   196   5 3210  387 1842  3 811 53   986  
     19 44             69                                           66          8515027440   691   1 3577  254 6904  6 473 86   900  
 
     XX XX             XX                                           XX          XXXXX X XX   XXX   X XXXX  XXX XXXX  X XXX XX   XXX  
     XX XX                                                          X            XXXX         X    X X      X              X         
     XX XX                                                          X             XXX         X      X      X                        
      X X                                                           X             XXX         X      X      X                        
      X X                                                           X             XXX         X      X      X                        
      X X                                                           X             XXX                       X                        
      X X                                                           X             XXX                                                
      X X                                                           X             XXX                                                
        X                                                           X              XX                                                
        X                                                           X              X                                                 
        X                                                           X              X                                                 
        X                                                           X              X                                                 
        X                                                           X              X                                                 
        X                                                           X              X                                                 
        X                                                           X              X                                                 
        X                                                                          X                                                 
        X                                                                          X                                                 
                                                                                   X                                                 
                                                                                   X                                                 
                                                                                   X                                                 
 
 ***** Axes restored to original set *****
 -------------------------------------------------------------------
 Center     Atomic                   Forces (Hartrees/Bohr)
 Number     Number              X              Y              Z
 -------------------------------------------------------------------
      1        6           0.000011927    0.000008036   -0.000000449
      2        8           0.000000843   -0.000010721    0.000004190
      3        8          -0.000000785   -0.000000837    0.000001173
      4        6          -0.000003677   -0.000003648   -0.000004793
      5        6          -0.000006845   -0.000016616    0.000005352
      6        6           0.000004306    0.000000083   -0.000001205
      7        8          -0.000005931    0.000008061   -0.000000754
      8        8           0.000003501    0.000000616    0.000003380
      9        8          -0.000004346    0.000000887    0.000006984
     10        8           0.000000503    0.000000039   -0.000002243
     11        1          -0.000001790   -0.000003411   -0.000002441
     12        1           0.000004758    0.000007190   -0.000004825
     13        1           0.000000702    0.000002931    0.000000283
     14        1          -0.000002836   -0.000002321   -0.000001089
     15        1          -0.000001578    0.000004136    0.000000919
     16        1           0.000001250    0.000005574   -0.000004482
 -------------------------------------------------------------------
 Cartesian Forces:  Max     0.000016616 RMS     0.000004954
 End of FrcOut F.D. properties on file   721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) frequency  1    0.088559:
                 1             2             3 
      1   0.733376D+02 -0.604575D+01 -0.235849D-03
      2  -0.604575D+01  0.775211D+02  0.220631D-03
      3  -0.235849D-03  0.220631D-03  0.623877D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.088559:
                 1             2             3 
      1   0.846329D+01  0.541656D+01  0.948779D-04
      2  -0.259828D+02 -0.952296D+01 -0.668174D-03
      3   0.371681D-03  0.582309D-04  0.139577D+01
 Property number 4 -- D-Q polarizability frequency  1    0.088559:
                 1             2             3 
      1  -0.432222D-02  0.180311D-02 -0.411275D+02
      2   0.250531D-02 -0.511983D-03 -0.927972D+00
      3   0.181691D-02 -0.129113D-02  0.420554D+02
      4   0.236832D-03  0.140153D-02 -0.140830D+02
      5  -0.187467D+02 -0.375899D+01  0.435561D-03
      6  -0.976004D+00  0.142310D+01 -0.174277D-02
 End of FrcOut F.D. properties on file   722 Mask=       B NFrqRd=     1 NDeriv=    48 ND12= 1 LenFil=    1731:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1   0.110268D-01 -0.110807D+01  0.220525D+00  0.126208D+01 -0.109401D+01
      2  -0.110807D+01 -0.819931D+00 -0.810197D+00 -0.109401D+01  0.502948D+01
      3   0.220525D+00 -0.810197D+00 -0.813540D+00  0.109444D+00  0.100743D+01
                 6             7             8             9            10 
      1   0.109444D+00  0.136407D+01 -0.151470D+01 -0.189678D+00  0.162354D+01
      2   0.100743D+01 -0.151470D+01  0.129236D+01 -0.644596D+00 -0.252039D+01
      3   0.483239D+00 -0.189678D+00 -0.644596D+00 -0.179936D-01 -0.513829D+00
                11            12            13            14            15 
      1  -0.252039D+01 -0.513829D+00 -0.429196D+01  0.424245D+00 -0.109196D+01
      2  -0.147232D+00 -0.190876D-01  0.424245D+00 -0.112064D+02 -0.187217D+01
      3  -0.190876D-01  0.776004D+00 -0.109196D+01 -0.187217D+01 -0.295191D+01
                16            17            18            19            20 
      1  -0.108196D+01  0.302118D+00 -0.129119D-01 -0.567416D+01  0.146802D+01
      2   0.302118D+00 -0.258962D+01 -0.285320D+01  0.146802D+01 -0.874434D+00
      3  -0.129119D-01 -0.285320D+01 -0.246550D+01 -0.179895D+01  0.367449D+00
                21            22            23            24            25 
      1  -0.179895D+01 -0.678955D+00 -0.111858D+01 -0.456535D+00 -0.292253D+01
      2   0.367449D+00 -0.111858D+01 -0.137535D+01 -0.199912D+01  0.693054D+00
      3  -0.116245D+01 -0.456535D+00 -0.199912D+01 -0.548300D+00 -0.281815D+01
                26            27            28            29            30 
      1   0.693054D+00 -0.281815D+01 -0.395954D+01  0.159794D+01 -0.752840D-01
      2  -0.219327D+01  0.917860D+00  0.159794D+01  0.108267D+01  0.488867D-01
      3   0.917860D+00 -0.350907D+01 -0.752840D-01  0.488867D-01  0.229209D+01
                31            32            33            34            35 
      1   0.231002D+01  0.185562D+01 -0.622979D+00 -0.555746D+00  0.156259D+00
      2   0.185562D+01 -0.234635D+01 -0.726823D+00  0.156259D+00 -0.410237D+00
      3  -0.622979D+00 -0.726823D+00  0.314369D+01  0.213406D+01  0.200075D+01
                36            37            38            39            40 
      1   0.213406D+01  0.396007D+01 -0.159755D+01 -0.760077D-01 -0.230939D+01
      2   0.200075D+01 -0.159755D+01 -0.108270D+01  0.486987D-01 -0.185550D+01
      3  -0.240339D+01 -0.760077D-01  0.486987D-01 -0.229172D+01 -0.623009D+00
                41            42            43            44            45 
      1  -0.185550D+01 -0.623009D+00 -0.556274D+00  0.155929D+00 -0.213343D+01
      2   0.234691D+01 -0.727283D+00  0.155929D+00 -0.410725D+00 -0.200032D+01
      3  -0.727283D+00 -0.314325D+01 -0.213343D+01 -0.200032D+01 -0.240388D+01
                46            47            48            49            50 
      1  -0.118057D-01  0.110787D+01  0.220824D+00 -0.126279D+01  0.109346D+01
      2   0.110787D+01  0.819266D+00 -0.809919D+00  0.109346D+01 -0.503009D+01
      3   0.220824D+00 -0.809919D+00  0.812953D+00  0.109756D+00  0.100763D+01
                51            52            53            54            55 
      1   0.109756D+00  0.136423D+01 -0.151428D+01  0.189140D+00 -0.162307D+01
      2   0.100763D+01 -0.151428D+01  0.129214D+01  0.644359D+00  0.252045D+01
      3  -0.483454D+00  0.189140D+00  0.644359D+00 -0.178633D-01 -0.513735D+00
                56            57            58            59            60 
      1   0.252045D+01 -0.513735D+00  0.429231D+01 -0.423791D+00 -0.109213D+01
      2   0.147740D+00 -0.191685D-01 -0.423791D+00  0.112067D+02 -0.187212D+01
      3  -0.191685D-01 -0.775779D+00 -0.109213D+01 -0.187212D+01  0.295204D+01
                61            62            63            64            65 
      1  -0.108175D+01  0.302051D+00  0.131035D-01 -0.422985D+01  0.148874D+01
      2   0.302051D+00 -0.258922D+01  0.285311D+01  0.148874D+01 -0.202766D+01
      3   0.131035D-01  0.285311D+01 -0.246517D+01  0.165522D+01 -0.220366D+00
                66            67            68            69            70 
      1   0.165522D+01 -0.376664D+00 -0.215842D+01  0.931124D+00  0.273316D+01
      2  -0.220366D+00 -0.215842D+01  0.586286D+01  0.185999D+01 -0.719193D-01
      3  -0.193188D+01  0.931124D+00  0.185999D+01  0.857571D-01 -0.188733D+01
                71            72            73            74            75 
      1  -0.719193D-01 -0.188733D+01  0.422991D+01 -0.148860D+01  0.165517D+01
      2   0.199181D+01  0.154077D+01 -0.148860D+01  0.202844D+01 -0.220502D+00
      3   0.154077D+01  0.253508D+01  0.165517D+01 -0.220502D+00  0.193184D+01
                76            77            78            79            80 
      1   0.376834D+00  0.215879D+01  0.931020D+00  0.273240D+01 -0.718454D-01
      2   0.215879D+01 -0.586224D+01  0.186014D+01 -0.718454D-01  0.199192D+01
      3   0.931020D+00  0.186014D+01 -0.857995D-01  0.188691D+01 -0.154082D+01
                81            82            83            84            85 
      1   0.188691D+01  0.567378D+01 -0.146804D+01 -0.179899D+01  0.678778D+00
      2  -0.154082D+01 -0.146804D+01  0.874488D+00  0.367386D+00  0.111844D+01
      3   0.253468D+01 -0.179899D+01  0.367386D+00  0.116255D+01 -0.456459D+00
                86            87            88            89            90 
      1   0.111844D+01 -0.456459D+00 -0.292237D+01  0.693031D+00  0.281810D+01
      2   0.137546D+01 -0.199911D+01  0.693031D+00 -0.219324D+01 -0.917914D+00
      3  -0.199911D+01  0.548243D+00  0.281810D+01 -0.917914D+00 -0.350936D+01
                91            92            93            94            95 
      1  -0.139359D+01 -0.833770D+00  0.182063D+01 -0.139020D+01 -0.100038D+01
      2  -0.833770D+00 -0.852447D+00  0.272585D+00 -0.100038D+01 -0.108856D+01
      3   0.182063D+01  0.272585D+00 -0.234122D+01  0.557315D+00  0.151614D+01
                96            97            98            99           100 
      1   0.557315D+00  0.223077D+01  0.439775D+00 -0.224055D+01  0.139339D+01
      2   0.151614D+01  0.439775D+00  0.161881D+01 -0.138897D+01  0.833755D+00
      3  -0.225922D+01 -0.224055D+01 -0.138897D+01  0.635411D+01  0.182064D+01
               101           102           103           104           105 
      1   0.833755D+00  0.182064D+01  0.139011D+01  0.100038D+01  0.557302D+00
      2   0.852442D+00  0.272592D+00  0.100038D+01  0.108855D+01  0.151612D+01
      3   0.272592D+00  0.234109D+01  0.557302D+00  0.151612D+01  0.225916D+01
               106           107           108           109           110 
      1   0.223080D+01  0.439810D+00  0.224038D+01  0.877320D+00 -0.852162D+00
      2   0.439810D+00  0.161892D+01  0.138896D+01 -0.852162D+00  0.646912D+00
      3   0.224038D+01  0.138896D+01  0.635404D+01  0.384276D+00  0.153560D+00
               111           112           113           114           115 
      1   0.384276D+00 -0.269618D+01  0.119369D+01  0.103223D+01  0.123515D+01
      2   0.153560D+00  0.119369D+01 -0.433163D+01  0.407757D+00  0.136581D-01
      3  -0.860117D-02  0.103223D+01  0.407757D+00 -0.182995D+01 -0.388206D+00
               116           117           118           119           120 
      1   0.136581D-01 -0.388206D+00 -0.877227D+00  0.852162D+00  0.384389D+00
      2   0.104351D+01 -0.880753D+00  0.852162D+00 -0.646911D+00  0.153534D+00
      3  -0.880753D+00  0.542570D+00  0.384389D+00  0.153534D+00  0.858842D-02
               121           122           123           124           125 
      1   0.269638D+01 -0.119362D+01  0.103222D+01  0.123537D+01  0.136645D-01
      2  -0.119362D+01  0.433141D+01  0.407874D+00  0.136645D-01  0.104358D+01
      3   0.103222D+01  0.407874D+00  0.182987D+01  0.388179D+00  0.880763D+00
               126           127           128           129           130 
      1   0.388179D+00  0.363171D+01  0.343513D+00 -0.169258D+01  0.161170D+01
      2   0.880763D+00  0.343513D+00  0.105790D+01  0.207258D+00  0.312772D+00
      3   0.542581D+00 -0.169258D+01  0.207258D+00  0.147800D+01 -0.458667D+00
               131           132           133           134           135 
      1   0.312772D+00 -0.458667D+00 -0.300312D+01 -0.182626D-01  0.111443D+01
      2   0.251487D+01 -0.193260D+00 -0.182626D-01 -0.753431D+00  0.425310D+00
      3  -0.193260D+00  0.113632D+01  0.111443D+01  0.425310D+00 -0.103573D+01
               136           137           138           139           140 
      1  -0.363150D+01 -0.343863D+00 -0.169230D+01 -0.161209D+01 -0.313101D+00
      2  -0.343863D+00 -0.105855D+01  0.207292D+00 -0.313101D+00 -0.251565D+01
      3  -0.169230D+01  0.207292D+00 -0.147792D+01 -0.458677D+00 -0.193197D+00
               141           142           143           144 
      1  -0.458677D+00 -0.300220D+01 -0.183386D-01 -0.111405D+01
      2  -0.193197D+00 -0.183386D-01 -0.753295D+00 -0.425304D+00
      3  -0.113643D+01 -0.111405D+01 -0.425304D+00 -0.103511D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.192608D+01 -0.305266D+01 -0.255362D+01 -0.359836D+01 -0.464040D+01
      2   0.970822D+01  0.537093D+01  0.585240D+01  0.603099D+01 -0.692194D+00
      3   0.337955D+01 -0.509513D+01 -0.266186D+01 -0.553437D+01  0.381690D+01
                 6             7             8             9            10 
      1   0.272082D+01  0.466491D+00  0.415199D+01  0.357418D+01  0.225288D+01
      2   0.223250D+01 -0.445480D+01  0.424056D+00 -0.929965D+01 -0.470522D+00
      3   0.259942D+01 -0.735221D+01  0.493938D+01 -0.237059D+01 -0.662828D+01
                11            12            13            14            15 
      1   0.156310D+00  0.900927D+00 -0.223502D+01  0.435182D+01 -0.974201D+01
      2  -0.207394D+01  0.422212D+00 -0.165016D+01  0.337910D+01  0.288524D+01
      3  -0.782309D+00  0.237228D+00  0.139506D+02 -0.168454D+02 -0.509529D+00
                16            17            18            19            20 
      1  -0.160524D+01  0.194702D+01 -0.416638D+01 -0.178547D+00  0.228741D+01
      2  -0.402890D+01  0.508369D+01  0.551262D+01 -0.140745D+01 -0.111061D+01
      3   0.434527D+01 -0.383927D+01 -0.405378D+01  0.995132D+00 -0.679287D+01
                21            22            23            24            25 
      1   0.207694D+01  0.201229D+01  0.405175D+01  0.840627D+00 -0.476710D+00
      2   0.498852D+01 -0.817351D+00  0.431057D+01  0.678819D+00  0.287769D+01
      3   0.100800D+00 -0.149531D+01 -0.592007D+01 -0.650066D+01 -0.463131D+00
                26            27            28            29            30 
      1   0.626315D+01  0.136124D+01  0.191943D+01  0.133055D+01 -0.291882D+00
      2   0.826972D+00  0.108136D+02  0.875703D+01 -0.615307D+00  0.127043D+01
      3  -0.870942D+01  0.107648D+01  0.120180D+01 -0.176685D+01 -0.285851D+00
                31            32            33            34            35 
      1   0.286558D+01 -0.311348D+01 -0.120297D+01  0.545361D+00  0.349132D+01
      2  -0.498911D+01 -0.151142D+01  0.776805D+00 -0.592549D+01 -0.511024D+00
      3   0.345468D+01 -0.158742D+01 -0.152602D+01  0.100021D+00 -0.976923D+00
                36            37            38            39            40 
      1   0.207156D+01 -0.191880D+01 -0.133051D+01 -0.292024D+00 -0.286520D+01
      2   0.187729D+01 -0.875858D+01  0.614337D+00  0.127218D+01  0.498757D+01
      3   0.107112D+01  0.120108D+01 -0.176665D+01  0.285997D+00  0.345494D+01
                41            42            43            44            45 
      1   0.311494D+01 -0.120342D+01  0.544655D+00  0.349070D+01 -0.207083D+01
      2   0.151043D+01  0.777562D+00 -0.592369D+01 -0.509649D+00 -0.187943D+01
      3  -0.158857D+01  0.152646D+01 -0.994485D-01  0.977320D+00  0.107028D+01
                46            47            48            49            50 
      1   0.192522D+01  0.305236D+01 -0.255218D+01  0.359782D+01  0.463908D+01
      2  -0.970716D+01 -0.536929D+01  0.585141D+01 -0.602846D+01  0.693270D+00
      3   0.337938D+01 -0.509440D+01  0.266118D+01 -0.553501D+01  0.381731D+01
                51            52            53            54            55 
      1   0.272129D+01  0.466181D+00  0.415224D+01 -0.357331D+01 -0.225272D+01
      2   0.223052D+01 -0.445513D+01  0.423314D+00  0.930039D+01  0.471220D+00
      3  -0.259954D+01  0.735035D+01 -0.493882D+01 -0.236969D+01 -0.662733D+01
                56            57            58            59            60 
      1  -0.156488D+00  0.900124D+00  0.223477D+01 -0.435172D+01 -0.974190D+01
      2   0.207370D+01  0.422370D+00  0.164914D+01 -0.337908D+01  0.288597D+01
      3  -0.783184D+00 -0.237064D+00  0.139504D+02 -0.168447D+02  0.509389D+00
                61            62            63            64            65 
      1  -0.160517D+01  0.194713D+01  0.416562D+01 -0.400157D+01 -0.259281D+01
      2  -0.402902D+01  0.508320D+01 -0.551168D+01  0.617994D+00 -0.201773D+01
      3  -0.434439D+01  0.383890D+01 -0.405349D+01 -0.120532D+02 -0.587433D+01
                66            67            68            69            70 
      1   0.519368D+01 -0.571745D+01  0.522908D+01 -0.195554D+01  0.496215D+01
      2   0.416293D+01 -0.719854D+00  0.588899D+00 -0.204697D+01 -0.229072D+01
      3   0.564056D+01  0.260157D+00  0.402355D+01  0.546956D+01  0.900170D+01
                71            72            73            74            75 
      1   0.477450D+01 -0.381400D+01  0.400138D+01  0.259374D+01  0.519342D+01
      2  -0.136196D+01 -0.182249D+01 -0.618881D+00  0.201755D+01  0.416252D+01
      3   0.281832D+01 -0.308260D+01 -0.120533D+02 -0.587568D+01 -0.563980D+01
                76            77            78            79            80 
      1   0.571819D+01 -0.522862D+01 -0.195479D+01  0.496088D+01  0.477490D+01
      2   0.720000D+00 -0.589173D+00 -0.204697D+01 -0.229113D+01 -0.136196D+01
      3   0.258077D+00  0.402266D+01 -0.546990D+01 -0.899972D+01 -0.281868D+01
                81            82            83            84            85 
      1   0.381267D+01  0.178789D+00 -0.228733D+01  0.207650D+01 -0.201187D+01
      2   0.182228D+01  0.140764D+01  0.111023D+01  0.498818D+01  0.817076D+00
      3  -0.308119D+01  0.994970D+00 -0.679275D+01 -0.100732D+00 -0.149399D+01
                86            87            88            89            90 
      1  -0.405192D+01  0.840991D+00 -0.476455D+00  0.626339D+01 -0.136156D+01
      2  -0.431056D+01  0.679104D+00  0.287696D+01  0.826882D+00 -0.108135D+02
      3  -0.591971D+01  0.650026D+01  0.463143D+00  0.870895D+01  0.107656D+01
                91            92            93            94            95 
      1  -0.945378D+00 -0.128260D+01 -0.120545D-01 -0.121038D+01 -0.136824D+01
      2   0.255625D+00  0.537635D+00  0.857872D-01  0.174619D+01 -0.752086D-02
      3  -0.485476D+00 -0.170552D+01  0.192088D+00  0.301013D+00 -0.115902D+01
                96            97            98            99           100 
      1   0.103930D+01  0.141833D+00  0.340506D+01 -0.108792D+01  0.945300D+00
      2   0.721559D+00 -0.286602D+01  0.293220D+00 -0.226156D+01 -0.255252D+00
      3   0.162199D+01 -0.307791D+00  0.208591D+01 -0.641383D+00 -0.485295D+00
               101           102           103           104           105 
      1   0.128252D+01 -0.121719D-01  0.121039D+01  0.136793D+01  0.103919D+01
      2  -0.537654D+00  0.856595D-01 -0.174611D+01  0.751102D-02  0.721497D+00
      3  -0.170540D+01 -0.192021D+00  0.301147D+00 -0.115875D+01 -0.162193D+01
               106           107           108           109           110 
      1   0.141825D+00  0.340498D+01  0.108745D+01  0.148331D+01  0.101600D+01
      2  -0.286606D+01  0.293039D+00  0.226193D+01  0.533769D-01 -0.547539D+00
      3   0.307927D+00 -0.208601D+01 -0.641149D+00  0.274501D+01 -0.577448D+00
               111           112           113           114           115 
      1  -0.708890D+00  0.734746D+00  0.693805D+01 -0.370669D+01 -0.104517D+01
      2  -0.171127D+00  0.720964D+00  0.255266D+01 -0.469700D+01 -0.103614D+01
      3  -0.139235D+01  0.105927D+01  0.136833D+02 -0.381235D+01 -0.177985D+01
               116           117           118           119           120 
      1  -0.257357D+01  0.179600D+01 -0.148345D+01 -0.101625D+01 -0.708822D+00
      2  -0.311301D+01  0.320817D+01 -0.535062D-01  0.547581D+00 -0.171160D+00
      3  -0.561123D+01  0.357755D+01  0.274532D+01 -0.577101D+00  0.139244D+01
               121           122           123           124           125 
      1  -0.735057D+00 -0.693746D+01 -0.370644D+01 -0.104506D+01 -0.257342D+01
      2  -0.721129D+00 -0.255275D+01 -0.469695D+01 -0.103626D+01 -0.311306D+01
      3   0.105993D+01  0.136834D+02  0.381284D+01  0.178028D+01  0.561187D+01
               126           127           128           129           130 
      1  -0.179566D+01  0.693050D+01  0.213631D+01 -0.460501D+01  0.302448D+01
      2  -0.320823D+01 -0.159645D+01  0.490472D+00 -0.101416D+01 -0.494208D+00
      3   0.357762D+01  0.123565D+02  0.321441D+01 -0.677749D+01  0.633769D+01
               131           132           133           134           135 
      1   0.204500D+01 -0.359138D+01 -0.449962D+01 -0.207968D+01  0.377055D+01
      2   0.104149D+00 -0.550836D+00 -0.609776D+00 -0.130094D+00  0.174005D+01
      3   0.247561D+01 -0.265643D+01 -0.993876D+01 -0.261008D+01  0.442265D+01
               136           137           138           139           140 
      1  -0.693026D+01 -0.213655D+01 -0.460495D+01 -0.302480D+01 -0.204592D+01
      2   0.159657D+01 -0.490260D+00 -0.101363D+01  0.494456D+00 -0.103897D+00
      3   0.123567D+02  0.321486D+01  0.677678D+01  0.633879D+01  0.247741D+01
               141           142           143           144 
      1  -0.359161D+01 -0.449861D+01 -0.207934D+01 -0.376948D+01
      2  -0.550852D+00 -0.609489D+00 -0.130171D+00 -0.173966D+01
      3   0.265631D+01  0.993661D+01  0.260978D+01  0.442161D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.518935D+01 -0.875205D+00 -0.631388D+00  0.591129D+01  0.157937D+02
      2   0.255929D+01  0.160863D+01  0.375511D+01 -0.546006D+01 -0.237476D+02
      3   0.263006D+01 -0.733424D+00 -0.312372D+01 -0.451230D+00  0.795387D+01
      4   0.902543D+01  0.202334D+01  0.211386D+01 -0.870616D+01 -0.123176D+02
      5  -0.651812D+01  0.204890D+01 -0.183967D+00 -0.271419D+01 -0.191403D+01
      6  -0.120245D+01 -0.261720D+01  0.773255D+01 -0.379467D+01 -0.794708D+01
                 6             7             8             9            10 
      1   0.369029D+01 -0.107450D+02  0.858255D+01  0.329761D+01 -0.546154D+00
      2  -0.219698D+01  0.774602D+01 -0.873757D+01 -0.242469D+01  0.492149D+01
      3  -0.149331D+01  0.299896D+01  0.155021D+00 -0.872924D+00 -0.437533D+01
      4  -0.498549D+01 -0.400059D+00 -0.728550D+01  0.184353D+01  0.582003D+01
      5   0.488251D+01  0.622300D+00  0.427420D+01 -0.641264D+01  0.915225D+00
      6  -0.122923D+02  0.740018D+00 -0.129153D+01 -0.376410D+01  0.372620D+01
                11            12            13            14            15 
      1   0.905362D+01  0.269054D+01  0.900380D+01 -0.287755D+02 -0.357341D+01
      2  -0.408950D+01 -0.181945D+01 -0.328465D+01  0.477361D+02  0.316628D+01
      3  -0.496412D+01 -0.871086D+00 -0.571915D+01 -0.189606D+02  0.407128D+00
      4   0.134684D+02  0.245110D+01  0.152062D+02  0.322910D+02  0.578886D+01
      5   0.276438D+01  0.474349D+01  0.667806D+01  0.599179D+00  0.526671D+01
      6   0.392228D+00 -0.231045D+01  0.178437D+01  0.162919D+02  0.170962D+02
                16            17            18            19            20 
      1   0.395534D+01 -0.101532D+02 -0.110704D+02  0.415384D+02 -0.568185D+01
      2  -0.286622D+01  0.712860D+01  0.295520D+01 -0.250020D+02  0.271943D+01
      3  -0.108912D+01  0.302465D+01  0.811523D+01 -0.165364D+02  0.296243D+01
      4   0.304313D+01  0.753477D+01  0.834676D+01 -0.846636D+01  0.900868D+01
      5   0.562166D+01  0.588896D+01  0.593455D+01  0.152822D+02 -0.304608D+01
      6  -0.405486D+00  0.153874D+02  0.117956D+02 -0.340774D+01  0.304734D+01
                21            22            23            24            25 
      1   0.762415D+01 -0.319215D+00  0.211938D+01  0.272768D+01  0.133028D+02
      2  -0.674119D+01  0.251098D+00 -0.149470D+01 -0.203524D+01 -0.117027D+02
      3  -0.882958D+00  0.681171D-01 -0.624676D+00 -0.692438D+00 -0.160008D+01
      4  -0.279139D+01  0.111756D+02  0.430927D+01  0.891169D+01 -0.486886D+01
      5   0.142128D+02  0.782091D+00  0.945033D+01 -0.300101D+00  0.176147D+02
      6  -0.468332D+01  0.319167D+01 -0.204879D+01  0.775154D+01 -0.315503D+01
                26            27            28            29            30 
      1  -0.485981D+00  0.464625D+01  0.752870D+00 -0.277528D+01 -0.443619D+01
      2   0.666378D+00 -0.150287D+02  0.159946D+01  0.373213D+01 -0.414154D+01
      3  -0.180397D+00  0.103825D+02 -0.235233D+01 -0.956849D+00  0.857772D+01
      4   0.102735D+02 -0.373243D+01 -0.243971D+01 -0.135976D+01  0.174359D+01
      5  -0.525998D+01  0.196952D+02  0.807700D+00  0.122615D+01 -0.633858D+01
      6   0.686503D+01 -0.565255D+01  0.563057D+01  0.355029D+01 -0.141168D+01
                31            32            33            34            35 
      1   0.111534D+01  0.248727D+01 -0.314606D+01 -0.183354D+01 -0.344161D+01
      2   0.286509D+01 -0.435018D+01 -0.655989D+01 -0.349051D+01 -0.125003D+01
      3  -0.398042D+01  0.186291D+01  0.970594D+01  0.532405D+01  0.469164D+01
      4  -0.694901D+01  0.377928D+01  0.160447D+01  0.169171D+01  0.256843D+01
      5   0.229560D+01  0.473236D+01 -0.643116D+01 -0.490446D+01 -0.425552D+01
      6   0.183298D+01 -0.293228D+01 -0.778634D+01 -0.114643D+01  0.106224D+00
                36            37            38            39            40 
      1  -0.416756D+00  0.754332D+00 -0.277493D+01  0.443530D+01  0.111596D+01
      2   0.919496D+01  0.159911D+01  0.373243D+01  0.414146D+01  0.286426D+01
      3  -0.877820D+01 -0.235344D+01 -0.957502D+00 -0.857676D+01 -0.398022D+01
      4  -0.283301D+01 -0.243844D+01 -0.135960D+01 -0.174370D+01 -0.694878D+01
      5   0.134138D+02 -0.808390D+00 -0.122600D+01 -0.633760D+01 -0.229536D+01
      6   0.869874D+01 -0.563035D+01 -0.355081D+01 -0.141133D+01 -0.183364D+01
                41            42            43            44            45 
      1   0.248771D+01  0.314515D+01  0.183233D+01  0.344030D+01 -0.415684D+00
      2  -0.434984D+01  0.655954D+01  0.349023D+01  0.125079D+01  0.919406D+01
      3   0.186213D+01 -0.970470D+01 -0.532257D+01 -0.469109D+01 -0.877838D+01
      4   0.378115D+01 -0.160579D+01 -0.169222D+01 -0.256941D+01 -0.283207D+01
      5  -0.473388D+01 -0.643002D+01 -0.490217D+01 -0.425430D+01 -0.134150D+02
      6   0.293297D+01 -0.778741D+01 -0.114609D+01  0.106325D+00 -0.869899D+01
                46            47            48            49            50 
      1  -0.519015D+01 -0.874332D+00  0.631624D+00  0.591045D+01  0.157922D+02
      2   0.255972D+01  0.160697D+01 -0.375542D+01 -0.546011D+01 -0.237475D+02
      3   0.263042D+01 -0.732638D+00  0.312379D+01 -0.450342D+00  0.795528D+01
      4   0.902457D+01  0.202155D+01 -0.211315D+01 -0.870840D+01 -0.123195D+02
      5   0.651924D+01 -0.204835D+01 -0.184993D+00  0.271475D+01  0.191426D+01
      6   0.120245D+01  0.261812D+01  0.773118D+01  0.379444D+01  0.794723D+01
                51            52            53            54            55 
      1  -0.368919D+01  0.107446D+02 -0.858049D+01  0.329645D+01 -0.543878D+00
      2   0.219728D+01 -0.774497D+01  0.873606D+01 -0.242446D+01  0.492058D+01
      3   0.149191D+01 -0.299964D+01 -0.155570D+00 -0.871985D+00 -0.437670D+01
      4   0.498537D+01  0.400192D+00  0.728503D+01  0.184302D+01  0.582134D+01
      5   0.488145D+01  0.620793D+00  0.427344D+01  0.641323D+01 -0.915715D+00
      6  -0.122918D+02  0.739529D+00 -0.129177D+01  0.376312D+01 -0.372595D+01
                56            57            58            59            60 
      1   0.905291D+01 -0.268988D+01  0.900323D+01 -0.287741D+02  0.357252D+01
      2  -0.408806D+01  0.181938D+01 -0.328336D+01  0.477363D+02 -0.316603D+01
      3  -0.496485D+01  0.870501D+00 -0.571987D+01 -0.189622D+02 -0.406493D+00
      4   0.134707D+02 -0.245098D+01  0.152078D+02  0.322928D+02 -0.578847D+01
      5  -0.276416D+01  0.474387D+01 -0.667848D+01 -0.598844D+00  0.526756D+01
      6  -0.393178D+00 -0.230937D+01 -0.178437D+01 -0.162919D+02  0.170954D+02
                61            62            63            64            65 
      1  -0.395451D+01  0.101520D+02 -0.110691D+02  0.740466D+01  0.120408D+01
      2   0.286586D+01 -0.712722D+01  0.295541D+01 -0.387961D+01 -0.501708D+01
      3   0.108865D+01 -0.302473D+01  0.811366D+01 -0.352505D+01  0.381299D+01
      4  -0.304290D+01 -0.753373D+01  0.834695D+01 -0.112230D+02  0.107167D+02
      5   0.562191D+01  0.588910D+01 -0.593389D+01 -0.256994D+01  0.219875D+01
      6  -0.404634D+00  0.153871D+02 -0.117945D+02  0.821243D+01 -0.452133D+01
                66            67            68            69            70 
      1   0.206220D+01 -0.914572D+00 -0.118862D+02 -0.393218D+01  0.843633D+00
      2   0.108749D+01 -0.429392D+01  0.205023D+02  0.551410D+01  0.100052D+01
      3  -0.314969D+01  0.520850D+01 -0.861608D+01 -0.158192D+01 -0.184415D+01
      4   0.419757D+01  0.101909D+02 -0.141393D+02 -0.239769D+01  0.660255D+01
      5   0.905596D+01  0.130606D+01 -0.788328D+01 -0.185351D+01  0.740308D+01
      6  -0.527592D+01 -0.163622D+01  0.130385D+02  0.117420D+02 -0.549734D+01
                71            72            73            74            75 
      1  -0.588533D+01 -0.568173D+01  0.740579D+01  0.120569D+01 -0.206173D+01
      2   0.428527D+01 -0.326706D+01 -0.388125D+01 -0.501987D+01 -0.108766D+01
      3   0.160006D+01  0.894879D+01 -0.352454D+01  0.381418D+01  0.314939D+01
      4  -0.471026D+01 -0.572543D+01 -0.112236D+02  0.107164D+02 -0.419763D+01
      5  -0.402045D+01 -0.493246D+01  0.257131D+01 -0.219916D+01  0.905641D+01
      6   0.931940D+01  0.978589D+01 -0.821196D+01  0.452208D+01 -0.527592D+01
                76            77            78            79            80 
      1  -0.913564D+00 -0.118839D+02  0.393239D+01 -0.842925D+00  0.588593D+01
      2  -0.429498D+01  0.204984D+02 -0.551424D+01 -0.100104D+01 -0.428610D+01
      3   0.520855D+01 -0.861454D+01  0.158185D+01  0.184396D+01 -0.159983D+01
      4   0.101906D+02 -0.141405D+02  0.239833D+01 -0.660153D+01  0.470965D+01
      5  -0.130618D+01  0.788451D+01 -0.185410D+01  0.740327D+01 -0.402079D+01
      6   0.163684D+01 -0.130385D+02  0.117423D+02 -0.549610D+01  0.931896D+01
                81            82            83            84            85 
      1  -0.568118D+01  0.415352D+02 -0.568217D+01 -0.762424D+01 -0.319799D+00
      2  -0.326757D+01 -0.250007D+02  0.271988D+01  0.674133D+01  0.251470D+00
      3   0.894875D+01 -0.165345D+02  0.296230D+01  0.882908D+00  0.683286D-01
      4  -0.572507D+01 -0.846660D+01  0.900844D+01  0.279107D+01  0.111750D+02
      5   0.493244D+01 -0.152826D+02  0.304595D+01  0.142127D+02 -0.781929D+00
      6  -0.978499D+01  0.340742D+01 -0.304739D+01 -0.468298D+01 -0.319108D+01
                86            87            88            89            90 
      1   0.211887D+01 -0.272776D+01 -0.133018D+02  0.485677D+00  0.464526D+01
      2  -0.149498D+01  0.203510D+01  0.117020D+02 -0.666374D+00 -0.150288D+02
      3  -0.623890D+00  0.692659D+00  0.159979D+01  0.180696D+00  0.103835D+02
      4   0.430949D+01 -0.891118D+01  0.486898D+01 -0.102733D+02 -0.373263D+01
      5  -0.944979D+01 -0.300294D+00  0.176143D+02 -0.526006D+01 -0.196957D+02
      6   0.204869D+01  0.775112D+01 -0.315501D+01  0.686544D+01  0.565301D+01
                91            92            93            94            95 
      1   0.307384D+01  0.134324D+01 -0.340277D+00  0.638955D+00 -0.221294D+01
      2  -0.690804D+01 -0.180142D+01  0.685352D+01 -0.167184D+01 -0.167184D+01
      3   0.383419D+01  0.458181D+00 -0.651324D+01  0.103288D+01  0.388477D+01
      4   0.278065D+01  0.331631D+01 -0.175340D+01  0.423504D+01  0.334470D+01
      5  -0.919331D+01 -0.240066D+01  0.126372D+02 -0.355291D+01 -0.525840D+01
      6  -0.320595D+01 -0.249072D+01  0.268727D+01 -0.300141D+01 -0.528199D+01
                96            97            98            99           100 
      1   0.371035D+01 -0.245779D+00  0.243740D+01 -0.977286D+01  0.307355D+01
      2   0.378113D+01  0.666938D+01  0.274256D+01 -0.164767D+02 -0.690769D+01
      3  -0.749148D+01 -0.642360D+01 -0.517996D+01  0.262495D+02  0.383414D+01
      4  -0.392965D+01 -0.196520D+01 -0.367498D+01  0.336610D+01  0.278062D+01
      5   0.707666D+01  0.116881D+02  0.428965D+01 -0.200275D+02  0.919303D+01
      6   0.892976D+01  0.259035D+01  0.632509D+01 -0.859060D+01  0.320626D+01
               101           102           103           104           105 
      1   0.134322D+01  0.340491D+00  0.638896D+00 -0.221295D+01 -0.371018D+01
      2  -0.180140D+01 -0.685307D+01 -0.167161D+01 -0.167170D+01 -0.378083D+01
      3   0.458176D+00  0.651258D+01  0.103272D+01  0.388466D+01  0.749100D+01
      4   0.331639D+01  0.175353D+01  0.423504D+01  0.334478D+01  0.392975D+01
      5   0.240072D+01  0.126366D+02  0.355275D+01  0.525844D+01  0.707654D+01
      6   0.249075D+01  0.268731D+01  0.300143D+01  0.528212D+01  0.892977D+01
               106           107           108           109           110 
      1   0.246106D+00 -0.243740D+01 -0.977267D+01  0.384691D+01 -0.388277D+01
      2  -0.666904D+01 -0.274260D+01 -0.164759D+02 -0.641912D+00  0.611636D+00
      3   0.642293D+01  0.517999D+01  0.262485D+02 -0.320500D+01  0.327114D+01
      4   0.196537D+01  0.367527D+01  0.336628D+01 -0.479630D+01  0.413931D+01
      5   0.116875D+02  0.428981D+01  0.200274D+02  0.190554D+01  0.666624D+00
      6   0.259049D+01  0.632522D+01  0.859133D+01 -0.909892D-01 -0.130237D+00
               111           112           113           114           115 
      1   0.104775D+01 -0.111181D+02  0.270402D+01  0.261503D+01  0.661578D+01
      2  -0.112566D+01  0.475879D+01  0.374739D+01 -0.357488D+01 -0.343207D+01
      3   0.779066D-01  0.635935D+01 -0.645140D+01  0.959845D+00 -0.318371D+01
      4  -0.460298D+00  0.772616D+01 -0.195292D+02  0.809371D+00 -0.768092D+00
      5   0.136826D-01  0.501094D+01  0.182573D+01 -0.722043D+01 -0.111474D+01
      6  -0.222183D-01 -0.241955D+01  0.472649D+01  0.195061D+01  0.522658D+00
               116           117           118           119           120 
      1  -0.102847D+01 -0.174376D+01  0.384650D+01 -0.388273D+01 -0.104818D+01
      2  -0.238520D+00  0.227497D+01 -0.641615D+00  0.611492D+00  0.112595D+01
      3   0.126699D+01 -0.531208D+00 -0.320488D+01  0.327124D+01 -0.777757D-01
      4   0.453230D+01 -0.287878D+01 -0.479623D+01  0.413923D+01  0.460473D+00
      5  -0.348457D+01  0.341354D+01 -0.190606D+01 -0.666416D+00  0.136316D-01
      6   0.752361D+00  0.158262D+00  0.911655D-01  0.130060D+00 -0.223138D-01
               121           122           123           124           125 
      1  -0.111192D+02  0.270425D+01 -0.261505D+01 -0.661675D+01  0.102850D+01
      2   0.475941D+01  0.374684D+01  0.357488D+01  0.343269D+01  0.238397D+00
      3   0.635979D+01 -0.645109D+01 -0.959830D+00  0.318405D+01 -0.126690D+01
      4   0.772614D+01 -0.195288D+02 -0.809966D+00  0.768360D+00 -0.453277D+01
      5  -0.501073D+01 -0.182638D+01 -0.722041D+01 -0.111448D+01 -0.348477D+01
      6   0.241923D+01 -0.472584D+01  0.195017D+01  0.522486D+00  0.752271D+00
               126           127           128           129           130 
      1  -0.174359D+01 -0.198931D+01 -0.241635D+01 -0.299277D+01 -0.230078D+01
      2   0.227478D+01  0.290514D+01  0.425126D+01 -0.576541D+00  0.280377D+01
      3  -0.531193D+00 -0.915827D+00 -0.183491D+01  0.356931D+01 -0.502992D+00
      4  -0.287899D+01  0.627601D+01 -0.255351D+01 -0.223455D+01  0.379025D+01
      5  -0.341385D+01  0.160421D+01  0.122752D+01 -0.294703D+01  0.165400D+01
      6  -0.158365D+00 -0.444185D+01  0.404633D+01  0.328355D+01 -0.101407D+01
               131           132           133           134           135 
      1  -0.607026D+01 -0.177231D+00  0.140522D+01  0.173318D+01 -0.545548D-01
      2   0.109594D+02 -0.200067D+01 -0.130959D+01 -0.364831D+01  0.197645D+01
      3  -0.488918D+01  0.217790D+01 -0.956342D-01  0.191513D+01 -0.192189D+01
      4  -0.761865D+00 -0.514198D+00 -0.497413D+01  0.350418D+01  0.161312D+01
      5   0.738249D+00 -0.142061D+01 -0.262266D+00 -0.455196D+00  0.236964D+01
      6   0.148145D+01  0.380329D+01  0.332789D+01  0.129649D+01 -0.250632D+01
               136           137           138           139           140 
      1  -0.198982D+01 -0.241814D+01  0.299228D+01 -0.230214D+01 -0.607226D+01
      2   0.290629D+01  0.425399D+01  0.576437D+00  0.280565D+01  0.109630D+02
      3  -0.916469D+00 -0.183584D+01 -0.356872D+01 -0.503503D+00 -0.489072D+01
      4   0.627593D+01 -0.255144D+01  0.223411D+01  0.379110D+01 -0.761516D+00
      5  -0.160458D+01 -0.122794D+01 -0.294640D+01 -0.165446D+01 -0.738453D+00
      6   0.444074D+01 -0.404631D+01  0.328364D+01  0.101382D+01 -0.148270D+01
               141           142           143           144 
      1   0.177498D+00 -0.140538D+01 -0.173311D+01 -0.551213D-01
      2   0.200071D+01  0.130960D+01  0.364852D+01  0.197618D+01
      3  -0.217821D+01  0.957878D-01 -0.191540D+01 -0.192106D+01
      4   0.514374D+00  0.497269D+01 -0.350319D+01  0.161266D+01
      5  -0.142078D+01 -0.261859D+00 -0.455258D+00 -0.236893D+01
      6   0.380345D+01  0.332694D+01  0.129706D+01  0.250473D+01
 Leave Link  716 at Wed Jul 28 20:01:38 2021, MaxMem=  5637144576 cpu:               2.0 elap:               0.4
 (Enter /util/academic/gaussian/g16.A03/x86-64-SSE4_2/g16/l9999.exe)
 AllDun F.D. properties on file 20721 Mask=       B NFrqRd=     1 NDeriv=     1 ND12= 1 LenFil=      39:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) frequency  1    0.088559:
                 1             2             3 
      1   0.733376D+02 -0.604575D+01 -0.235849D-03
      2  -0.604575D+01  0.775211D+02  0.220631D-03
      3  -0.235849D-03  0.220631D-03  0.623877D+02
 Property number 2 -- FD Optical Rotation Tensor frequency  1    0.088559:
                 1             2             3 
      1   0.846329D+01  0.541656D+01  0.948779D-04
      2  -0.259828D+02 -0.952296D+01 -0.668174D-03
      3   0.371681D-03  0.582309D-04  0.139577D+01
 Property number 4 -- D-Q polarizability frequency  1    0.088559:
                 1             2             3 
      1  -0.432222D-02  0.180311D-02 -0.411275D+02
      2   0.250531D-02 -0.511983D-03 -0.927972D+00
      3   0.181691D-02 -0.129113D-02  0.420554D+02
      4   0.236832D-03  0.140153D-02 -0.140830D+02
      5  -0.187467D+02 -0.375899D+01  0.435561D-03
      6  -0.976004D+00  0.142310D+01 -0.174277D-02
 AllDun F.D. properties on file 20722 Mask=       B NFrqRd=     1 NDeriv=    48 ND12= 1 LenFil=    1731:
 Frequencies=    0.088559
 Property number 1 -- Alpha(-w,w) derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1   0.110268D-01 -0.110807D+01  0.220525D+00  0.126208D+01 -0.109401D+01
      2  -0.110807D+01 -0.819931D+00 -0.810197D+00 -0.109401D+01  0.502948D+01
      3   0.220525D+00 -0.810197D+00 -0.813540D+00  0.109444D+00  0.100743D+01
                 6             7             8             9            10 
      1   0.109444D+00  0.136407D+01 -0.151470D+01 -0.189678D+00  0.162354D+01
      2   0.100743D+01 -0.151470D+01  0.129236D+01 -0.644596D+00 -0.252039D+01
      3   0.483239D+00 -0.189678D+00 -0.644596D+00 -0.179936D-01 -0.513829D+00
                11            12            13            14            15 
      1  -0.252039D+01 -0.513829D+00 -0.429196D+01  0.424245D+00 -0.109196D+01
      2  -0.147232D+00 -0.190876D-01  0.424245D+00 -0.112064D+02 -0.187217D+01
      3  -0.190876D-01  0.776004D+00 -0.109196D+01 -0.187217D+01 -0.295191D+01
                16            17            18            19            20 
      1  -0.108196D+01  0.302118D+00 -0.129119D-01 -0.567416D+01  0.146802D+01
      2   0.302118D+00 -0.258962D+01 -0.285320D+01  0.146802D+01 -0.874434D+00
      3  -0.129119D-01 -0.285320D+01 -0.246550D+01 -0.179895D+01  0.367449D+00
                21            22            23            24            25 
      1  -0.179895D+01 -0.678955D+00 -0.111858D+01 -0.456535D+00 -0.292253D+01
      2   0.367449D+00 -0.111858D+01 -0.137535D+01 -0.199912D+01  0.693054D+00
      3  -0.116245D+01 -0.456535D+00 -0.199912D+01 -0.548300D+00 -0.281815D+01
                26            27            28            29            30 
      1   0.693054D+00 -0.281815D+01 -0.395954D+01  0.159794D+01 -0.752840D-01
      2  -0.219327D+01  0.917860D+00  0.159794D+01  0.108267D+01  0.488867D-01
      3   0.917860D+00 -0.350907D+01 -0.752840D-01  0.488867D-01  0.229209D+01
                31            32            33            34            35 
      1   0.231002D+01  0.185562D+01 -0.622979D+00 -0.555746D+00  0.156259D+00
      2   0.185562D+01 -0.234635D+01 -0.726823D+00  0.156259D+00 -0.410237D+00
      3  -0.622979D+00 -0.726823D+00  0.314369D+01  0.213406D+01  0.200075D+01
                36            37            38            39            40 
      1   0.213406D+01  0.396007D+01 -0.159755D+01 -0.760077D-01 -0.230939D+01
      2   0.200075D+01 -0.159755D+01 -0.108270D+01  0.486987D-01 -0.185550D+01
      3  -0.240339D+01 -0.760077D-01  0.486987D-01 -0.229172D+01 -0.623009D+00
                41            42            43            44            45 
      1  -0.185550D+01 -0.623009D+00 -0.556274D+00  0.155929D+00 -0.213343D+01
      2   0.234691D+01 -0.727283D+00  0.155929D+00 -0.410725D+00 -0.200032D+01
      3  -0.727283D+00 -0.314325D+01 -0.213343D+01 -0.200032D+01 -0.240388D+01
                46            47            48            49            50 
      1  -0.118057D-01  0.110787D+01  0.220824D+00 -0.126279D+01  0.109346D+01
      2   0.110787D+01  0.819266D+00 -0.809919D+00  0.109346D+01 -0.503009D+01
      3   0.220824D+00 -0.809919D+00  0.812953D+00  0.109756D+00  0.100763D+01
                51            52            53            54            55 
      1   0.109756D+00  0.136423D+01 -0.151428D+01  0.189140D+00 -0.162307D+01
      2   0.100763D+01 -0.151428D+01  0.129214D+01  0.644359D+00  0.252045D+01
      3  -0.483454D+00  0.189140D+00  0.644359D+00 -0.178633D-01 -0.513735D+00
                56            57            58            59            60 
      1   0.252045D+01 -0.513735D+00  0.429231D+01 -0.423791D+00 -0.109213D+01
      2   0.147740D+00 -0.191685D-01 -0.423791D+00  0.112067D+02 -0.187212D+01
      3  -0.191685D-01 -0.775779D+00 -0.109213D+01 -0.187212D+01  0.295204D+01
                61            62            63            64            65 
      1  -0.108175D+01  0.302051D+00  0.131035D-01 -0.422985D+01  0.148874D+01
      2   0.302051D+00 -0.258922D+01  0.285311D+01  0.148874D+01 -0.202766D+01
      3   0.131035D-01  0.285311D+01 -0.246517D+01  0.165522D+01 -0.220366D+00
                66            67            68            69            70 
      1   0.165522D+01 -0.376664D+00 -0.215842D+01  0.931124D+00  0.273316D+01
      2  -0.220366D+00 -0.215842D+01  0.586286D+01  0.185999D+01 -0.719193D-01
      3  -0.193188D+01  0.931124D+00  0.185999D+01  0.857571D-01 -0.188733D+01
                71            72            73            74            75 
      1  -0.719193D-01 -0.188733D+01  0.422991D+01 -0.148860D+01  0.165517D+01
      2   0.199181D+01  0.154077D+01 -0.148860D+01  0.202844D+01 -0.220502D+00
      3   0.154077D+01  0.253508D+01  0.165517D+01 -0.220502D+00  0.193184D+01
                76            77            78            79            80 
      1   0.376834D+00  0.215879D+01  0.931020D+00  0.273240D+01 -0.718454D-01
      2   0.215879D+01 -0.586224D+01  0.186014D+01 -0.718454D-01  0.199192D+01
      3   0.931020D+00  0.186014D+01 -0.857995D-01  0.188691D+01 -0.154082D+01
                81            82            83            84            85 
      1   0.188691D+01  0.567378D+01 -0.146804D+01 -0.179899D+01  0.678778D+00
      2  -0.154082D+01 -0.146804D+01  0.874488D+00  0.367386D+00  0.111844D+01
      3   0.253468D+01 -0.179899D+01  0.367386D+00  0.116255D+01 -0.456459D+00
                86            87            88            89            90 
      1   0.111844D+01 -0.456459D+00 -0.292237D+01  0.693031D+00  0.281810D+01
      2   0.137546D+01 -0.199911D+01  0.693031D+00 -0.219324D+01 -0.917914D+00
      3  -0.199911D+01  0.548243D+00  0.281810D+01 -0.917914D+00 -0.350936D+01
                91            92            93            94            95 
      1  -0.139359D+01 -0.833770D+00  0.182063D+01 -0.139020D+01 -0.100038D+01
      2  -0.833770D+00 -0.852447D+00  0.272585D+00 -0.100038D+01 -0.108856D+01
      3   0.182063D+01  0.272585D+00 -0.234122D+01  0.557315D+00  0.151614D+01
                96            97            98            99           100 
      1   0.557315D+00  0.223077D+01  0.439775D+00 -0.224055D+01  0.139339D+01
      2   0.151614D+01  0.439775D+00  0.161881D+01 -0.138897D+01  0.833755D+00
      3  -0.225922D+01 -0.224055D+01 -0.138897D+01  0.635411D+01  0.182064D+01
               101           102           103           104           105 
      1   0.833755D+00  0.182064D+01  0.139011D+01  0.100038D+01  0.557302D+00
      2   0.852442D+00  0.272592D+00  0.100038D+01  0.108855D+01  0.151612D+01
      3   0.272592D+00  0.234109D+01  0.557302D+00  0.151612D+01  0.225916D+01
               106           107           108           109           110 
      1   0.223080D+01  0.439810D+00  0.224038D+01  0.877320D+00 -0.852162D+00
      2   0.439810D+00  0.161892D+01  0.138896D+01 -0.852162D+00  0.646912D+00
      3   0.224038D+01  0.138896D+01  0.635404D+01  0.384276D+00  0.153560D+00
               111           112           113           114           115 
      1   0.384276D+00 -0.269618D+01  0.119369D+01  0.103223D+01  0.123515D+01
      2   0.153560D+00  0.119369D+01 -0.433163D+01  0.407757D+00  0.136581D-01
      3  -0.860117D-02  0.103223D+01  0.407757D+00 -0.182995D+01 -0.388206D+00
               116           117           118           119           120 
      1   0.136581D-01 -0.388206D+00 -0.877227D+00  0.852162D+00  0.384389D+00
      2   0.104351D+01 -0.880753D+00  0.852162D+00 -0.646911D+00  0.153534D+00
      3  -0.880753D+00  0.542570D+00  0.384389D+00  0.153534D+00  0.858842D-02
               121           122           123           124           125 
      1   0.269638D+01 -0.119362D+01  0.103222D+01  0.123537D+01  0.136645D-01
      2  -0.119362D+01  0.433141D+01  0.407874D+00  0.136645D-01  0.104358D+01
      3   0.103222D+01  0.407874D+00  0.182987D+01  0.388179D+00  0.880763D+00
               126           127           128           129           130 
      1   0.388179D+00  0.363171D+01  0.343513D+00 -0.169258D+01  0.161170D+01
      2   0.880763D+00  0.343513D+00  0.105790D+01  0.207258D+00  0.312772D+00
      3   0.542581D+00 -0.169258D+01  0.207258D+00  0.147800D+01 -0.458667D+00
               131           132           133           134           135 
      1   0.312772D+00 -0.458667D+00 -0.300312D+01 -0.182626D-01  0.111443D+01
      2   0.251487D+01 -0.193260D+00 -0.182626D-01 -0.753431D+00  0.425310D+00
      3  -0.193260D+00  0.113632D+01  0.111443D+01  0.425310D+00 -0.103573D+01
               136           137           138           139           140 
      1  -0.363150D+01 -0.343863D+00 -0.169230D+01 -0.161209D+01 -0.313101D+00
      2  -0.343863D+00 -0.105855D+01  0.207292D+00 -0.313101D+00 -0.251565D+01
      3  -0.169230D+01  0.207292D+00 -0.147792D+01 -0.458677D+00 -0.193197D+00
               141           142           143           144 
      1  -0.458677D+00 -0.300220D+01 -0.183386D-01 -0.111405D+01
      2  -0.193197D+00 -0.183386D-01 -0.753295D+00 -0.425304D+00
      3  -0.113643D+01 -0.111405D+01 -0.425304D+00 -0.103511D+01
 Property number 2 -- FD Optical Rotation Tensor derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.192608D+01 -0.305266D+01 -0.255362D+01 -0.359836D+01 -0.464040D+01
      2   0.970822D+01  0.537093D+01  0.585240D+01  0.603099D+01 -0.692194D+00
      3   0.337955D+01 -0.509513D+01 -0.266186D+01 -0.553437D+01  0.381690D+01
                 6             7             8             9            10 
      1   0.272082D+01  0.466491D+00  0.415199D+01  0.357418D+01  0.225288D+01
      2   0.223250D+01 -0.445480D+01  0.424056D+00 -0.929965D+01 -0.470522D+00
      3   0.259942D+01 -0.735221D+01  0.493938D+01 -0.237059D+01 -0.662828D+01
                11            12            13            14            15 
      1   0.156310D+00  0.900927D+00 -0.223502D+01  0.435182D+01 -0.974201D+01
      2  -0.207394D+01  0.422212D+00 -0.165016D+01  0.337910D+01  0.288524D+01
      3  -0.782309D+00  0.237228D+00  0.139506D+02 -0.168454D+02 -0.509529D+00
                16            17            18            19            20 
      1  -0.160524D+01  0.194702D+01 -0.416638D+01 -0.178547D+00  0.228741D+01
      2  -0.402890D+01  0.508369D+01  0.551262D+01 -0.140745D+01 -0.111061D+01
      3   0.434527D+01 -0.383927D+01 -0.405378D+01  0.995132D+00 -0.679287D+01
                21            22            23            24            25 
      1   0.207694D+01  0.201229D+01  0.405175D+01  0.840627D+00 -0.476710D+00
      2   0.498852D+01 -0.817351D+00  0.431057D+01  0.678819D+00  0.287769D+01
      3   0.100800D+00 -0.149531D+01 -0.592007D+01 -0.650066D+01 -0.463131D+00
                26            27            28            29            30 
      1   0.626315D+01  0.136124D+01  0.191943D+01  0.133055D+01 -0.291882D+00
      2   0.826972D+00  0.108136D+02  0.875703D+01 -0.615307D+00  0.127043D+01
      3  -0.870942D+01  0.107648D+01  0.120180D+01 -0.176685D+01 -0.285851D+00
                31            32            33            34            35 
      1   0.286558D+01 -0.311348D+01 -0.120297D+01  0.545361D+00  0.349132D+01
      2  -0.498911D+01 -0.151142D+01  0.776805D+00 -0.592549D+01 -0.511024D+00
      3   0.345468D+01 -0.158742D+01 -0.152602D+01  0.100021D+00 -0.976923D+00
                36            37            38            39            40 
      1   0.207156D+01 -0.191880D+01 -0.133051D+01 -0.292024D+00 -0.286520D+01
      2   0.187729D+01 -0.875858D+01  0.614337D+00  0.127218D+01  0.498757D+01
      3   0.107112D+01  0.120108D+01 -0.176665D+01  0.285997D+00  0.345494D+01
                41            42            43            44            45 
      1   0.311494D+01 -0.120342D+01  0.544655D+00  0.349070D+01 -0.207083D+01
      2   0.151043D+01  0.777562D+00 -0.592369D+01 -0.509649D+00 -0.187943D+01
      3  -0.158857D+01  0.152646D+01 -0.994485D-01  0.977320D+00  0.107028D+01
                46            47            48            49            50 
      1   0.192522D+01  0.305236D+01 -0.255218D+01  0.359782D+01  0.463908D+01
      2  -0.970716D+01 -0.536929D+01  0.585141D+01 -0.602846D+01  0.693270D+00
      3   0.337938D+01 -0.509440D+01  0.266118D+01 -0.553501D+01  0.381731D+01
                51            52            53            54            55 
      1   0.272129D+01  0.466181D+00  0.415224D+01 -0.357331D+01 -0.225272D+01
      2   0.223052D+01 -0.445513D+01  0.423314D+00  0.930039D+01  0.471220D+00
      3  -0.259954D+01  0.735035D+01 -0.493882D+01 -0.236969D+01 -0.662733D+01
                56            57            58            59            60 
      1  -0.156488D+00  0.900124D+00  0.223477D+01 -0.435172D+01 -0.974190D+01
      2   0.207370D+01  0.422370D+00  0.164914D+01 -0.337908D+01  0.288597D+01
      3  -0.783184D+00 -0.237064D+00  0.139504D+02 -0.168447D+02  0.509389D+00
                61            62            63            64            65 
      1  -0.160517D+01  0.194713D+01  0.416562D+01 -0.400157D+01 -0.259281D+01
      2  -0.402902D+01  0.508320D+01 -0.551168D+01  0.617994D+00 -0.201773D+01
      3  -0.434439D+01  0.383890D+01 -0.405349D+01 -0.120532D+02 -0.587433D+01
                66            67            68            69            70 
      1   0.519368D+01 -0.571745D+01  0.522908D+01 -0.195554D+01  0.496215D+01
      2   0.416293D+01 -0.719854D+00  0.588899D+00 -0.204697D+01 -0.229072D+01
      3   0.564056D+01  0.260157D+00  0.402355D+01  0.546956D+01  0.900170D+01
                71            72            73            74            75 
      1   0.477450D+01 -0.381400D+01  0.400138D+01  0.259374D+01  0.519342D+01
      2  -0.136196D+01 -0.182249D+01 -0.618881D+00  0.201755D+01  0.416252D+01
      3   0.281832D+01 -0.308260D+01 -0.120533D+02 -0.587568D+01 -0.563980D+01
                76            77            78            79            80 
      1   0.571819D+01 -0.522862D+01 -0.195479D+01  0.496088D+01  0.477490D+01
      2   0.720000D+00 -0.589173D+00 -0.204697D+01 -0.229113D+01 -0.136196D+01
      3   0.258077D+00  0.402266D+01 -0.546990D+01 -0.899972D+01 -0.281868D+01
                81            82            83            84            85 
      1   0.381267D+01  0.178789D+00 -0.228733D+01  0.207650D+01 -0.201187D+01
      2   0.182228D+01  0.140764D+01  0.111023D+01  0.498818D+01  0.817076D+00
      3  -0.308119D+01  0.994970D+00 -0.679275D+01 -0.100732D+00 -0.149399D+01
                86            87            88            89            90 
      1  -0.405192D+01  0.840991D+00 -0.476455D+00  0.626339D+01 -0.136156D+01
      2  -0.431056D+01  0.679104D+00  0.287696D+01  0.826882D+00 -0.108135D+02
      3  -0.591971D+01  0.650026D+01  0.463143D+00  0.870895D+01  0.107656D+01
                91            92            93            94            95 
      1  -0.945378D+00 -0.128260D+01 -0.120545D-01 -0.121038D+01 -0.136824D+01
      2   0.255625D+00  0.537635D+00  0.857872D-01  0.174619D+01 -0.752086D-02
      3  -0.485476D+00 -0.170552D+01  0.192088D+00  0.301013D+00 -0.115902D+01
                96            97            98            99           100 
      1   0.103930D+01  0.141833D+00  0.340506D+01 -0.108792D+01  0.945300D+00
      2   0.721559D+00 -0.286602D+01  0.293220D+00 -0.226156D+01 -0.255252D+00
      3   0.162199D+01 -0.307791D+00  0.208591D+01 -0.641383D+00 -0.485295D+00
               101           102           103           104           105 
      1   0.128252D+01 -0.121719D-01  0.121039D+01  0.136793D+01  0.103919D+01
      2  -0.537654D+00  0.856595D-01 -0.174611D+01  0.751102D-02  0.721497D+00
      3  -0.170540D+01 -0.192021D+00  0.301147D+00 -0.115875D+01 -0.162193D+01
               106           107           108           109           110 
      1   0.141825D+00  0.340498D+01  0.108745D+01  0.148331D+01  0.101600D+01
      2  -0.286606D+01  0.293039D+00  0.226193D+01  0.533769D-01 -0.547539D+00
      3   0.307927D+00 -0.208601D+01 -0.641149D+00  0.274501D+01 -0.577448D+00
               111           112           113           114           115 
      1  -0.708890D+00  0.734746D+00  0.693805D+01 -0.370669D+01 -0.104517D+01
      2  -0.171127D+00  0.720964D+00  0.255266D+01 -0.469700D+01 -0.103614D+01
      3  -0.139235D+01  0.105927D+01  0.136833D+02 -0.381235D+01 -0.177985D+01
               116           117           118           119           120 
      1  -0.257357D+01  0.179600D+01 -0.148345D+01 -0.101625D+01 -0.708822D+00
      2  -0.311301D+01  0.320817D+01 -0.535062D-01  0.547581D+00 -0.171160D+00
      3  -0.561123D+01  0.357755D+01  0.274532D+01 -0.577101D+00  0.139244D+01
               121           122           123           124           125 
      1  -0.735057D+00 -0.693746D+01 -0.370644D+01 -0.104506D+01 -0.257342D+01
      2  -0.721129D+00 -0.255275D+01 -0.469695D+01 -0.103626D+01 -0.311306D+01
      3   0.105993D+01  0.136834D+02  0.381284D+01  0.178028D+01  0.561187D+01
               126           127           128           129           130 
      1  -0.179566D+01  0.693050D+01  0.213631D+01 -0.460501D+01  0.302448D+01
      2  -0.320823D+01 -0.159645D+01  0.490472D+00 -0.101416D+01 -0.494208D+00
      3   0.357762D+01  0.123565D+02  0.321441D+01 -0.677749D+01  0.633769D+01
               131           132           133           134           135 
      1   0.204500D+01 -0.359138D+01 -0.449962D+01 -0.207968D+01  0.377055D+01
      2   0.104149D+00 -0.550836D+00 -0.609776D+00 -0.130094D+00  0.174005D+01
      3   0.247561D+01 -0.265643D+01 -0.993876D+01 -0.261008D+01  0.442265D+01
               136           137           138           139           140 
      1  -0.693026D+01 -0.213655D+01 -0.460495D+01 -0.302480D+01 -0.204592D+01
      2   0.159657D+01 -0.490260D+00 -0.101363D+01  0.494456D+00 -0.103897D+00
      3   0.123567D+02  0.321486D+01  0.677678D+01  0.633879D+01  0.247741D+01
               141           142           143           144 
      1  -0.359161D+01 -0.449861D+01 -0.207934D+01 -0.376948D+01
      2  -0.550852D+00 -0.609489D+00 -0.130171D+00 -0.173966D+01
      3   0.265631D+01  0.993661D+01  0.260978D+01  0.442161D+01
 Property number 4 -- D-Q polarizability derivatives, frequency  1    0.088559:
                 1             2             3             4             5 
      1  -0.518935D+01 -0.875205D+00 -0.631388D+00  0.591129D+01  0.157937D+02
      2   0.255929D+01  0.160863D+01  0.375511D+01 -0.546006D+01 -0.237476D+02
      3   0.263006D+01 -0.733424D+00 -0.312372D+01 -0.451230D+00  0.795387D+01
      4   0.902543D+01  0.202334D+01  0.211386D+01 -0.870616D+01 -0.123176D+02
      5  -0.651812D+01  0.204890D+01 -0.183967D+00 -0.271419D+01 -0.191403D+01
      6  -0.120245D+01 -0.261720D+01  0.773255D+01 -0.379467D+01 -0.794708D+01
                 6             7             8             9            10 
      1   0.369029D+01 -0.107450D+02  0.858255D+01  0.329761D+01 -0.546154D+00
      2  -0.219698D+01  0.774602D+01 -0.873757D+01 -0.242469D+01  0.492149D+01
      3  -0.149331D+01  0.299896D+01  0.155021D+00 -0.872924D+00 -0.437533D+01
      4  -0.498549D+01 -0.400059D+00 -0.728550D+01  0.184353D+01  0.582003D+01
      5   0.488251D+01  0.622300D+00  0.427420D+01 -0.641264D+01  0.915225D+00
      6  -0.122923D+02  0.740018D+00 -0.129153D+01 -0.376410D+01  0.372620D+01
                11            12            13            14            15 
      1   0.905362D+01  0.269054D+01  0.900380D+01 -0.287755D+02 -0.357341D+01
      2  -0.408950D+01 -0.181945D+01 -0.328465D+01  0.477361D+02  0.316628D+01
      3  -0.496412D+01 -0.871086D+00 -0.571915D+01 -0.189606D+02  0.407128D+00
      4   0.134684D+02  0.245110D+01  0.152062D+02  0.322910D+02  0.578886D+01
      5   0.276438D+01  0.474349D+01  0.667806D+01  0.599179D+00  0.526671D+01
      6   0.392228D+00 -0.231045D+01  0.178437D+01  0.162919D+02  0.170962D+02
                16            17            18            19            20 
      1   0.395534D+01 -0.101532D+02 -0.110704D+02  0.415384D+02 -0.568185D+01
      2  -0.286622D+01  0.712860D+01  0.295520D+01 -0.250020D+02  0.271943D+01
      3  -0.108912D+01  0.302465D+01  0.811523D+01 -0.165364D+02  0.296243D+01
      4   0.304313D+01  0.753477D+01  0.834676D+01 -0.846636D+01  0.900868D+01
      5   0.562166D+01  0.588896D+01  0.593455D+01  0.152822D+02 -0.304608D+01
      6  -0.405486D+00  0.153874D+02  0.117956D+02 -0.340774D+01  0.304734D+01
                21            22            23            24            25 
      1   0.762415D+01 -0.319215D+00  0.211938D+01  0.272768D+01  0.133028D+02
      2  -0.674119D+01  0.251098D+00 -0.149470D+01 -0.203524D+01 -0.117027D+02
      3  -0.882958D+00  0.681171D-01 -0.624676D+00 -0.692438D+00 -0.160008D+01
      4  -0.279139D+01  0.111756D+02  0.430927D+01  0.891169D+01 -0.486886D+01
      5   0.142128D+02  0.782091D+00  0.945033D+01 -0.300101D+00  0.176147D+02
      6  -0.468332D+01  0.319167D+01 -0.204879D+01  0.775154D+01 -0.315503D+01
                26            27            28            29            30 
      1  -0.485981D+00  0.464625D+01  0.752870D+00 -0.277528D+01 -0.443619D+01
      2   0.666378D+00 -0.150287D+02  0.159946D+01  0.373213D+01 -0.414154D+01
      3  -0.180397D+00  0.103825D+02 -0.235233D+01 -0.956849D+00  0.857772D+01
      4   0.102735D+02 -0.373243D+01 -0.243971D+01 -0.135976D+01  0.174359D+01
      5  -0.525998D+01  0.196952D+02  0.807700D+00  0.122615D+01 -0.633858D+01
      6   0.686503D+01 -0.565255D+01  0.563057D+01  0.355029D+01 -0.141168D+01
                31            32            33            34            35 
      1   0.111534D+01  0.248727D+01 -0.314606D+01 -0.183354D+01 -0.344161D+01
      2   0.286509D+01 -0.435018D+01 -0.655989D+01 -0.349051D+01 -0.125003D+01
      3  -0.398042D+01  0.186291D+01  0.970594D+01  0.532405D+01  0.469164D+01
      4  -0.694901D+01  0.377928D+01  0.160447D+01  0.169171D+01  0.256843D+01
      5   0.229560D+01  0.473236D+01 -0.643116D+01 -0.490446D+01 -0.425552D+01
      6   0.183298D+01 -0.293228D+01 -0.778634D+01 -0.114643D+01  0.106224D+00
                36            37            38            39            40 
      1  -0.416756D+00  0.754332D+00 -0.277493D+01  0.443530D+01  0.111596D+01
      2   0.919496D+01  0.159911D+01  0.373243D+01  0.414146D+01  0.286426D+01
      3  -0.877820D+01 -0.235344D+01 -0.957502D+00 -0.857676D+01 -0.398022D+01
      4  -0.283301D+01 -0.243844D+01 -0.135960D+01 -0.174370D+01 -0.694878D+01
      5   0.134138D+02 -0.808390D+00 -0.122600D+01 -0.633760D+01 -0.229536D+01
      6   0.869874D+01 -0.563035D+01 -0.355081D+01 -0.141133D+01 -0.183364D+01
                41            42            43            44            45 
      1   0.248771D+01  0.314515D+01  0.183233D+01  0.344030D+01 -0.415684D+00
      2  -0.434984D+01  0.655954D+01  0.349023D+01  0.125079D+01  0.919406D+01
      3   0.186213D+01 -0.970470D+01 -0.532257D+01 -0.469109D+01 -0.877838D+01
      4   0.378115D+01 -0.160579D+01 -0.169222D+01 -0.256941D+01 -0.283207D+01
      5  -0.473388D+01 -0.643002D+01 -0.490217D+01 -0.425430D+01 -0.134150D+02
      6   0.293297D+01 -0.778741D+01 -0.114609D+01  0.106325D+00 -0.869899D+01
                46            47            48            49            50 
      1  -0.519015D+01 -0.874332D+00  0.631624D+00  0.591045D+01  0.157922D+02
      2   0.255972D+01  0.160697D+01 -0.375542D+01 -0.546011D+01 -0.237475D+02
      3   0.263042D+01 -0.732638D+00  0.312379D+01 -0.450342D+00  0.795528D+01
      4   0.902457D+01  0.202155D+01 -0.211315D+01 -0.870840D+01 -0.123195D+02
      5   0.651924D+01 -0.204835D+01 -0.184993D+00  0.271475D+01  0.191426D+01
      6   0.120245D+01  0.261812D+01  0.773118D+01  0.379444D+01  0.794723D+01
                51            52            53            54            55 
      1  -0.368919D+01  0.107446D+02 -0.858049D+01  0.329645D+01 -0.543878D+00
      2   0.219728D+01 -0.774497D+01  0.873606D+01 -0.242446D+01  0.492058D+01
      3   0.149191D+01 -0.299964D+01 -0.155570D+00 -0.871985D+00 -0.437670D+01
      4   0.498537D+01  0.400192D+00  0.728503D+01  0.184302D+01  0.582134D+01
      5   0.488145D+01  0.620793D+00  0.427344D+01  0.641323D+01 -0.915715D+00
      6  -0.122918D+02  0.739529D+00 -0.129177D+01  0.376312D+01 -0.372595D+01
                56            57            58            59            60 
      1   0.905291D+01 -0.268988D+01  0.900323D+01 -0.287741D+02  0.357252D+01
      2  -0.408806D+01  0.181938D+01 -0.328336D+01  0.477363D+02 -0.316603D+01
      3  -0.496485D+01  0.870501D+00 -0.571987D+01 -0.189622D+02 -0.406493D+00
      4   0.134707D+02 -0.245098D+01  0.152078D+02  0.322928D+02 -0.578847D+01
      5  -0.276416D+01  0.474387D+01 -0.667848D+01 -0.598844D+00  0.526756D+01
      6  -0.393178D+00 -0.230937D+01 -0.178437D+01 -0.162919D+02  0.170954D+02
                61            62            63            64            65 
      1  -0.395451D+01  0.101520D+02 -0.110691D+02  0.740466D+01  0.120408D+01
      2   0.286586D+01 -0.712722D+01  0.295541D+01 -0.387961D+01 -0.501708D+01
      3   0.108865D+01 -0.302473D+01  0.811366D+01 -0.352505D+01  0.381299D+01
      4  -0.304290D+01 -0.753373D+01  0.834695D+01 -0.112230D+02  0.107167D+02
      5   0.562191D+01  0.588910D+01 -0.593389D+01 -0.256994D+01  0.219875D+01
      6  -0.404634D+00  0.153871D+02 -0.117945D+02  0.821243D+01 -0.452133D+01
                66            67            68            69            70 
      1   0.206220D+01 -0.914572D+00 -0.118862D+02 -0.393218D+01  0.843633D+00
      2   0.108749D+01 -0.429392D+01  0.205023D+02  0.551410D+01  0.100052D+01
      3  -0.314969D+01  0.520850D+01 -0.861608D+01 -0.158192D+01 -0.184415D+01
      4   0.419757D+01  0.101909D+02 -0.141393D+02 -0.239769D+01  0.660255D+01
      5   0.905596D+01  0.130606D+01 -0.788328D+01 -0.185351D+01  0.740308D+01
      6  -0.527592D+01 -0.163622D+01  0.130385D+02  0.117420D+02 -0.549734D+01
                71            72            73            74            75 
      1  -0.588533D+01 -0.568173D+01  0.740579D+01  0.120569D+01 -0.206173D+01
      2   0.428527D+01 -0.326706D+01 -0.388125D+01 -0.501987D+01 -0.108766D+01
      3   0.160006D+01  0.894879D+01 -0.352454D+01  0.381418D+01  0.314939D+01
      4  -0.471026D+01 -0.572543D+01 -0.112236D+02  0.107164D+02 -0.419763D+01
      5  -0.402045D+01 -0.493246D+01  0.257131D+01 -0.219916D+01  0.905641D+01
      6   0.931940D+01  0.978589D+01 -0.821196D+01  0.452208D+01 -0.527592D+01
                76            77            78            79            80 
      1  -0.913564D+00 -0.118839D+02  0.393239D+01 -0.842925D+00  0.588593D+01
      2  -0.429498D+01  0.204984D+02 -0.551424D+01 -0.100104D+01 -0.428610D+01
      3   0.520855D+01 -0.861454D+01  0.158185D+01  0.184396D+01 -0.159983D+01
      4   0.101906D+02 -0.141405D+02  0.239833D+01 -0.660153D+01  0.470965D+01
      5  -0.130618D+01  0.788451D+01 -0.185410D+01  0.740327D+01 -0.402079D+01
      6   0.163684D+01 -0.130385D+02  0.117423D+02 -0.549610D+01  0.931896D+01
                81            82            83            84            85 
      1  -0.568118D+01  0.415352D+02 -0.568217D+01 -0.762424D+01 -0.319799D+00
      2  -0.326757D+01 -0.250007D+02  0.271988D+01  0.674133D+01  0.251470D+00
      3   0.894875D+01 -0.165345D+02  0.296230D+01  0.882908D+00  0.683286D-01
      4  -0.572507D+01 -0.846660D+01  0.900844D+01  0.279107D+01  0.111750D+02
      5   0.493244D+01 -0.152826D+02  0.304595D+01  0.142127D+02 -0.781929D+00
      6  -0.978499D+01  0.340742D+01 -0.304739D+01 -0.468298D+01 -0.319108D+01
                86            87            88            89            90 
      1   0.211887D+01 -0.272776D+01 -0.133018D+02  0.485677D+00  0.464526D+01
      2  -0.149498D+01  0.203510D+01  0.117020D+02 -0.666374D+00 -0.150288D+02
      3  -0.623890D+00  0.692659D+00  0.159979D+01  0.180696D+00  0.103835D+02
      4   0.430949D+01 -0.891118D+01  0.486898D+01 -0.102733D+02 -0.373263D+01
      5  -0.944979D+01 -0.300294D+00  0.176143D+02 -0.526006D+01 -0.196957D+02
      6   0.204869D+01  0.775112D+01 -0.315501D+01  0.686544D+01  0.565301D+01
                91            92            93            94            95 
      1   0.307384D+01  0.134324D+01 -0.340277D+00  0.638955D+00 -0.221294D+01
      2  -0.690804D+01 -0.180142D+01  0.685352D+01 -0.167184D+01 -0.167184D+01
      3   0.383419D+01  0.458181D+00 -0.651324D+01  0.103288D+01  0.388477D+01
      4   0.278065D+01  0.331631D+01 -0.175340D+01  0.423504D+01  0.334470D+01
      5  -0.919331D+01 -0.240066D+01  0.126372D+02 -0.355291D+01 -0.525840D+01
      6  -0.320595D+01 -0.249072D+01  0.268727D+01 -0.300141D+01 -0.528199D+01
                96            97            98            99           100 
      1   0.371035D+01 -0.245779D+00  0.243740D+01 -0.977286D+01  0.307355D+01
      2   0.378113D+01  0.666938D+01  0.274256D+01 -0.164767D+02 -0.690769D+01
      3  -0.749148D+01 -0.642360D+01 -0.517996D+01  0.262495D+02  0.383414D+01
      4  -0.392965D+01 -0.196520D+01 -0.367498D+01  0.336610D+01  0.278062D+01
      5   0.707666D+01  0.116881D+02  0.428965D+01 -0.200275D+02  0.919303D+01
      6   0.892976D+01  0.259035D+01  0.632509D+01 -0.859060D+01  0.320626D+01
               101           102           103           104           105 
      1   0.134322D+01  0.340491D+00  0.638896D+00 -0.221295D+01 -0.371018D+01
      2  -0.180140D+01 -0.685307D+01 -0.167161D+01 -0.167170D+01 -0.378083D+01
      3   0.458176D+00  0.651258D+01  0.103272D+01  0.388466D+01  0.749100D+01
      4   0.331639D+01  0.175353D+01  0.423504D+01  0.334478D+01  0.392975D+01
      5   0.240072D+01  0.126366D+02  0.355275D+01  0.525844D+01  0.707654D+01
      6   0.249075D+01  0.268731D+01  0.300143D+01  0.528212D+01  0.892977D+01
               106           107           108           109           110 
      1   0.246106D+00 -0.243740D+01 -0.977267D+01  0.384691D+01 -0.388277D+01
      2  -0.666904D+01 -0.274260D+01 -0.164759D+02 -0.641912D+00  0.611636D+00
      3   0.642293D+01  0.517999D+01  0.262485D+02 -0.320500D+01  0.327114D+01
      4   0.196537D+01  0.367527D+01  0.336628D+01 -0.479630D+01  0.413931D+01
      5   0.116875D+02  0.428981D+01  0.200274D+02  0.190554D+01  0.666624D+00
      6   0.259049D+01  0.632522D+01  0.859133D+01 -0.909892D-01 -0.130237D+00
               111           112           113           114           115 
      1   0.104775D+01 -0.111181D+02  0.270402D+01  0.261503D+01  0.661578D+01
      2  -0.112566D+01  0.475879D+01  0.374739D+01 -0.357488D+01 -0.343207D+01
      3   0.779066D-01  0.635935D+01 -0.645140D+01  0.959845D+00 -0.318371D+01
      4  -0.460298D+00  0.772616D+01 -0.195292D+02  0.809371D+00 -0.768092D+00
      5   0.136826D-01  0.501094D+01  0.182573D+01 -0.722043D+01 -0.111474D+01
      6  -0.222183D-01 -0.241955D+01  0.472649D+01  0.195061D+01  0.522658D+00
               116           117           118           119           120 
      1  -0.102847D+01 -0.174376D+01  0.384650D+01 -0.388273D+01 -0.104818D+01
      2  -0.238520D+00  0.227497D+01 -0.641615D+00  0.611492D+00  0.112595D+01
      3   0.126699D+01 -0.531208D+00 -0.320488D+01  0.327124D+01 -0.777757D-01
      4   0.453230D+01 -0.287878D+01 -0.479623D+01  0.413923D+01  0.460473D+00
      5  -0.348457D+01  0.341354D+01 -0.190606D+01 -0.666416D+00  0.136316D-01
      6   0.752361D+00  0.158262D+00  0.911655D-01  0.130060D+00 -0.223138D-01
               121           122           123           124           125 
      1  -0.111192D+02  0.270425D+01 -0.261505D+01 -0.661675D+01  0.102850D+01
      2   0.475941D+01  0.374684D+01  0.357488D+01  0.343269D+01  0.238397D+00
      3   0.635979D+01 -0.645109D+01 -0.959830D+00  0.318405D+01 -0.126690D+01
      4   0.772614D+01 -0.195288D+02 -0.809966D+00  0.768360D+00 -0.453277D+01
      5  -0.501073D+01 -0.182638D+01 -0.722041D+01 -0.111448D+01 -0.348477D+01
      6   0.241923D+01 -0.472584D+01  0.195017D+01  0.522486D+00  0.752271D+00
               126           127           128           129           130 
      1  -0.174359D+01 -0.198931D+01 -0.241635D+01 -0.299277D+01 -0.230078D+01
      2   0.227478D+01  0.290514D+01  0.425126D+01 -0.576541D+00  0.280377D+01
      3  -0.531193D+00 -0.915827D+00 -0.183491D+01  0.356931D+01 -0.502992D+00
      4  -0.287899D+01  0.627601D+01 -0.255351D+01 -0.223455D+01  0.379025D+01
      5  -0.341385D+01  0.160421D+01  0.122752D+01 -0.294703D+01  0.165400D+01
      6  -0.158365D+00 -0.444185D+01  0.404633D+01  0.328355D+01 -0.101407D+01
               131           132           133           134           135 
      1  -0.607026D+01 -0.177231D+00  0.140522D+01  0.173318D+01 -0.545548D-01
      2   0.109594D+02 -0.200067D+01 -0.130959D+01 -0.364831D+01  0.197645D+01
      3  -0.488918D+01  0.217790D+01 -0.956342D-01  0.191513D+01 -0.192189D+01
      4  -0.761865D+00 -0.514198D+00 -0.497413D+01  0.350418D+01  0.161312D+01
      5   0.738249D+00 -0.142061D+01 -0.262266D+00 -0.455196D+00  0.236964D+01
      6   0.148145D+01  0.380329D+01  0.332789D+01  0.129649D+01 -0.250632D+01
               136           137           138           139           140 
      1  -0.198982D+01 -0.241814D+01  0.299228D+01 -0.230214D+01 -0.607226D+01
      2   0.290629D+01  0.425399D+01  0.576437D+00  0.280565D+01  0.109630D+02
      3  -0.916469D+00 -0.183584D+01 -0.356872D+01 -0.503503D+00 -0.489072D+01
      4   0.627593D+01 -0.255144D+01  0.223411D+01  0.379110D+01 -0.761516D+00
      5  -0.160458D+01 -0.122794D+01 -0.294640D+01 -0.165446D+01 -0.738453D+00
      6   0.444074D+01 -0.404631D+01  0.328364D+01  0.101382D+01 -0.148270D+01
               141           142           143           144 
      1   0.177498D+00 -0.140538D+01 -0.173311D+01 -0.551213D-01
      2   0.200071D+01  0.130960D+01  0.364852D+01  0.197618D+01
      3  -0.217821D+01  0.957878D-01 -0.191540D+01 -0.192106D+01
      4   0.514374D+00  0.497269D+01 -0.350319D+01  0.161266D+01
      5  -0.142078D+01 -0.261859D+00 -0.455258D+00 -0.236893D+01
      6   0.380345D+01  0.332694D+01  0.129706D+01  0.250473D+01

 ----------------------------------------------------------------------

 Electric dipole moment (input orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.935565D+00      0.237797D+01      0.793205D+01
   x         -0.219189D-04     -0.557122D-04     -0.185836D-03
   y         -0.101866D-03     -0.258916D-03     -0.863652D-03
   z          0.935565D+00      0.237797D+01      0.793205D+01

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.657275D+02      0.973980D+01      0.108370D+02
   aniso      0.167597D+02      0.248353D+01      0.276330D+01
   xx         0.682333D+02      0.101111D+02      0.112502D+02
   yx        -0.589845D+01     -0.874060D+00     -0.972522D+00
   yy         0.718317D+02      0.106444D+02      0.118435D+02
   zx        -0.296794D-03     -0.439804D-04     -0.489348D-04
   zy         0.199159D-03      0.295122D-04      0.328368D-04
   zz         0.571173D+02      0.846392D+01      0.941738D+01

 Dipole polarizability, Alpha (input orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  514.5nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.710821D+02      0.105333D+02      0.117199D+02
   aniso      0.171132D+02      0.253592D+01      0.282159D+01
   xx         0.733376D+02      0.108675D+02      0.120917D+02
   yx        -0.604575D+01     -0.895888D+00     -0.996810D+00
   yy         0.775211D+02      0.114874D+02      0.127815D+02
   zx        -0.235849D-03     -0.349492D-04     -0.388862D-04
   zy         0.220631D-03      0.326941D-04      0.363771D-04
   zz         0.623877D+02      0.924491D+01      0.102863D+02

 ----------------------------------------------------------------------

 Dipole orientation:
     6         -2.76735853         -0.96502805         -0.57007385
     8         -2.31696074         -3.11815562         -1.19555530
     8         -4.48337387          0.44921833         -1.71637645
     6         -1.42254131          0.31564008          1.65808247
     6          1.42263979         -0.31523177          1.65805615
     6          2.76726756          0.96486607         -0.57045900
     8          2.31696707          3.11792165         -1.19628239
     8         -1.89866432          2.93902700          1.70264174
     8          1.89885183         -2.93862214          1.70328911
     8          4.48316494         -0.44963936         -1.71660582
     1         -2.23579019         -0.50729097          3.37023765
     1          2.23594810          0.50809288          3.36999020
     1          4.43580667         -2.10957318         -0.90336175
     1         -4.43594537          2.10930842         -0.90345073
     1         -0.57361606          3.73426375          0.68145216
     1          0.57369527         -3.73431743          0.68262209

 Electric dipole moment (dipole orientation):
 (Debye = 10**-18 statcoulomb cm , SI units = C m)
                  (au)            (Debye)         (10**-30 SI)
   Tot        0.935565D+00      0.237797D+01      0.793205D+01
   x          0.000000D+00      0.000000D+00      0.000000D+00
   y          0.000000D+00      0.000000D+00      0.000000D+00
   z          0.935565D+00      0.237797D+01      0.793205D+01

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(0;0):
               (au)            (10**-24 esu)      (10**-40 SI)
   iso        0.657275D+02      0.973980D+01      0.108370D+02
   aniso      0.167597D+02      0.248353D+01      0.276330D+01
   xx         0.682333D+02      0.101111D+02      0.112502D+02
   yx        -0.589845D+01     -0.874060D+00     -0.972522D+00
   yy         0.718317D+02      0.106444D+02      0.118435D+02
   zx         0.850065D-04      0.125967D-04      0.140157D-04
   zy        -0.126477D-02     -0.187420D-03     -0.208533D-03
   zz         0.571173D+02      0.846392D+01      0.941738D+01

 Dipole polarizability, Alpha (dipole orientation).
 (esu units = cm**3 , SI units = C**2 m**2 J**-1)
 Alpha(-w;w) w=  514.5nm:
                  (au)         (10**-24 esu)      (10**-40 SI)
   iso        0.710821D+02      0.105333D+02      0.117199D+02
   aniso      0.171132D+02      0.253592D+01      0.282159D+01
   xx         0.733376D+02      0.108675D+02      0.120917D+02
   yx        -0.604575D+01     -0.895888D+00     -0.996810D+00
   yy         0.775211D+02      0.114874D+02      0.127815D+02
   zx         0.165883D-03      0.245813D-04      0.273504D-04
   zy        -0.128546D-02     -0.190486D-03     -0.211944D-03
   zz         0.623877D+02      0.924491D+01      0.102863D+02

 ----------------------------------------------------------------------

 Test job not archived.
 1\1\GINC-CPN-K10-12-02\Freq\RLC-PBEPBE\Gen\C4H6O6\PIERPA\28-Jul-2021\0
 \\#P SP LC-PBEPBE/Gen Integral=UltraFineGrid SCF=(NoSymm,MaxCyc=120,Ti
 ght) Polar=ROA Guess=Read Geom=Check CPHF=RdFreq IOp(1/33=1,3/107=0373
 000000,3/108=0373000000,3/119=1000000000,3/120=1000000000,3/130=-1,3/1
 31=-1)\\ROA calculations.\\0,1\C,-1.464416,-0.510638,-0.30176\O,-1.226
 068,-1.649988,-0.632869\O,-2.372478,0.237815,-0.908297\C,-0.752797,0.1
 66934,0.87742\C,0.752808,-0.166909,0.877405\C,1.464382,0.510618,-0.301
 784\O,1.226101,1.650002,-0.632837\O,-1.004751,1.555168,0.901145\O,1.00
 4808,-1.55515,0.901196\O,2.37241,-0.23784,-0.908359\H,-1.183171,-0.268
 641,1.783396\H,1.183171,0.268677,1.783379\H,2.347339,-1.116286,-0.4781
 05\H,-2.34739,1.11625,-0.478019\H,-0.303553,1.976048,0.360817\H,0.3035
 78,-1.976155,0.36102\\Version=ES64L-G16RevA.03\State=1-A\HF=-607.69511
 88\RMSD=6.009e-09\RMSF=4.954e-06\ZeroPoint=0.1169407\Thermal=0.1260638
 \Dipole=-0.0000219,-0.0001019,0.9355647\DipoleDeriv=0.9334346,-0.50840
 94,0.3791769,-0.4900212,1.3941675,0.068481,0.5088354,0.0572613,0.69882
 65,-0.6540085,0.0806218,-0.1534919,0.2548945,-1.0726127,-0.0962138,-0.
 1275894,-0.2619643,-0.5115302,-0.8229695,0.4454134,-0.229819,0.3086214
 ,-0.7512361,0.0860247,-0.4034444,0.2337699,-0.4946095,0.2383657,0.0327
 329,-0.0898045,-0.0617603,0.6146949,0.0397084,-0.0859898,-0.053107,0.1
 294824,0.2383041,0.0327307,0.0898072,-0.0617788,0.6147158,-0.0397442,0
 .0860139,0.0530905,0.1294354,0.933376,-0.5083671,-0.3791992,-0.4900039
 ,1.3941956,-0.0684236,-0.5088594,-0.0572048,0.6988727,-0.6540376,0.080
 5871,0.1535213,0.2549022,-1.0726207,0.0961929,0.1275975,0.2619336,-0.5
 115177,-0.6428317,0.0070498,-0.04282,-0.0065145,-0.8767972,-0.0508903,
 -0.0255813,-0.06468,-0.4755094,-0.6427531,0.0070623,0.0428391,-0.00648
 16,-0.8768108,0.050925,0.0256253,0.0647257,-0.4755113,-0.8229178,0.445
 4147,0.2298347,0.3086217,-0.7512448,-0.0860492,0.4034384,-0.2338059,-0
 .4946329,0.009695,-0.0421155,0.034318,-0.0318913,-0.0004725,0.0074854,
 0.0309331,0.0456181,0.001518,0.0097061,-0.0421167,-0.0343117,-0.031888
 4,-0.0004743,-0.0074736,-0.030928,-0.0456151,0.0015351,0.4162721,-0.01
 81066,-0.0604988,-0.0035309,0.3613304,-0.0251749,-0.0839435,-0.0268145
 ,0.3391596,0.4162839,-0.018104,0.0604973,-0.0035182,0.3613256,0.025178
 1,0.0839459,0.0268175,0.3391441,0.5221017,0.0028057,-0.1060354,0.03018
 31,0.3309063,-0.0174067,-0.1437112,0.0107391,0.31267,0.521979,0.002801
 1,0.1059859,0.030166,0.330933,0.0173806,0.1436573,-0.010764,0.3126672\
 Polar=68.233301,-5.8984467,71.8317213,-0.0002968,0.0001992,57.1173438\
 Quadrupole=1.1165558,-1.1305738,0.014018,-4.2916948,-0.0003356,-0.0003
 436\PG=C01 [X(C4H6O6)]\NImag=0\\0.43110923,-0.17683860,0.91760720,0.12
 787400,0.16137439,0.44866197,-0.10604062,0.09130425,0.01356954,0.10996
 174,0.08958420,-0.62349362,-0.18501025,-0.14591792,0.72563335,0.013019
 49,-0.18134132,-0.15409395,0.00051103,0.19776216,0.13301267,-0.1930188
 5,0.05233932,-0.12198570,-0.00888517,0.05151530,0.00326623,0.24486723,
 0.09232266,-0.14339013,0.05619588,0.06562390,-0.07759932,0.02288508,-0
 .12183452,0.57042667,-0.10352334,0.01416560,-0.15793128,0.01006230,0.0
 0936600,0.02777879,0.16469695,0.12064595,0.26545894,-0.10925827,-0.011
 67456,-0.01817736,0.01724948,0.00799015,0.00160097,-0.00819861,0.00435
 723,-0.03656555,0.47306563,-0.02844540,-0.07653954,-0.02567872,-0.0038
 5022,-0.02101564,-0.02828594,0.02147229,-0.00353954,0.01408532,0.02271
 049,0.50497846,-0.02423904,-0.00490530,-0.13183600,-0.00593122,-0.0166
 9598,0.00607002,-0.02505321,-0.00431484,-0.00686083,-0.04218642,-0.059
 79904,0.51914592,-0.02350789,-0.00305360,-0.00969137,0.00004006,0.0054
 2459,0.00121259,0.00043737,-0.00052409,0.00065868,-0.15948115,-0.00616
 639,0.00480605,0.47306677,-0.01306134,0.02117672,0.01328064,0.00909988
 ,-0.01049746,0.00066341,-0.00052729,-0.00235426,-0.00605022,-0.0061641
 5,-0.07183101,-0.00072005,0.02271912,0.50496481,-0.03019194,0.00597865
 ,0.00117405,0.00281636,0.00075158,-0.00074850,-0.00177046,-0.00038363,
 -0.00618095,-0.00480232,0.00072291,-0.07283437,0.04216455,0.05977547,0
 .51916859,-0.00051149,-0.00433857,-0.00034350,-0.00041197,0.00235672,0
 .00086523,0.00057955,0.00147626,0.00093301,-0.02350879,-0.01306015,0.0
 3019348,-0.10926566,-0.02845354,0.02425554,0.43110438,-0.00433922,0.00
 716685,-0.00370918,0.00339958,-0.00424415,-0.00097679,0.00267476,-0.00
 525747,0.00334507,-0.00305559,0.02117868,-0.00597929,-0.01167995,-0.07
 654520,0.00492088,-0.17680318,0.91763039,0.00034322,0.00371015,0.00886
 410,0.00012203,-0.00196708,-0.00317946,-0.00179132,0.00063532,-0.00382
 940,0.00969398,-0.01328223,0.00117418,0.01818768,0.02569186,-0.1318581
 1,-0.12790828,-0.16135511,0.44867970,-0.00041216,0.00339937,-0.0001216
 6,0.00065673,-0.00239447,-0.00092828,0.00012275,-0.00206180,0.00015722
 ,0.00003895,0.00910200,-0.00281651,0.01725120,-0.00385125,0.00592987,-
 0.10603034,0.09126996,-0.01355317,0.10994844,0.00235696,-0.00424396,0.
 00196660,-0.00239430,0.00328157,0.00010723,-0.00191181,0.00331576,-0.0
 0196911,0.00542588,-0.01049875,-0.00075127,0.00798623,-0.02101949,0.01
 669539,0.08955370,-0.62350731,0.18498680,-0.14588085,0.72565669,-0.000
 86507,0.00097621,-0.00317906,0.00092794,-0.00010693,0.00146353,0.00093
 333,-0.00077826,0.00235352,-0.00121237,-0.00066410,-0.00074835,-0.0015
 9834,0.02828777,0.00606882,-0.01300558,0.18131407,-0.15407732,-0.00053
 259,-0.19773146,0.13300042,-0.00304257,-0.00185933,-0.00242450,0.00387
 376,-0.00734236,-0.00312332,0.00189561,-0.01449481,-0.00470679,-0.0915
 9080,0.00454055,0.01781014,0.00176449,0.03440009,-0.00050924,0.0045360
 4,-0.01433547,0.00335734,-0.01734377,0.00905346,0.01167827,0.33915019,
 0.00920097,-0.03748371,0.00003683,-0.00396272,-0.00839538,-0.00957931,
 -0.00204182,0.00391625,-0.00365022,0.03706572,-0.21624931,-0.00939098,
 0.00577455,-0.02419632,-0.00249630,0.00090977,-0.01397569,0.00743747,-
 0.00605214,0.01327462,-0.00002984,0.08478591,0.42454555,-0.00369580,-0
 .01981514,-0.00124661,0.00037825,-0.00674605,-0.00325875,-0.00046679,-
 0.01239503,-0.00135986,0.01090900,0.01092072,-0.06987994,-0.00011090,0
 .00087499,0.00057927,-0.00126259,0.01126421,-0.00512635,0.01429474,-0.
 00736022,-0.00094054,-0.19429683,-0.08427370,0.21347001,0.00453618,-0.
 01433165,-0.00335690,-0.01733722,0.00905123,-0.01167516,-0.00240605,0.
 00441155,-0.00004990,0.00176561,0.03439890,0.00050758,-0.09159512,0.00
 453513,-0.01780923,-0.00304119,-0.00185933,0.00242358,0.00387343,-0.00
 734170,0.00312334,-0.00738474,0.00809839,-0.00194881,0.33919351,0.0009
 1062,-0.01397382,-0.00743696,-0.00604985,0.01327266,0.00003104,-0.0016
 4102,0.00462549,0.00189931,0.00577125,-0.02419295,0.00249637,0.0370661
 4,-0.21622476,0.00939475,0.00920298,-0.03748257,-0.00003463,-0.0039630
 7,-0.00839459,0.00957807,0.00809838,-0.00043982,0.00173910,0.08484159,
 0.42456935,0.00126289,-0.01126061,-0.00512531,-0.01429014,0.00735758,-
 0.00094009,-0.00083387,0.00391266,0.00065362,0.00010988,-0.00087380,0.
 00057800,-0.01090966,-0.01091431,-0.06987335,0.00369525,0.01981473,-0.
 00124874,-0.00037812,0.00674682,-0.00325803,0.00194813,-0.00173918,0.0
 0320213,0.19427540,0.08427533,0.21339692,0.00057937,0.00267450,0.00179
 119,0.00012272,-0.00191171,-0.00093329,-0.00056667,-0.00078792,-0.0007
 9571,0.00043753,-0.00052690,0.00176999,-0.00819608,0.02147327,0.025054
 07,-0.19301380,0.05234019,0.12199043,-0.00888175,0.05151289,-0.0032645
 1,-0.00240653,-0.00164137,0.00083426,0.00189556,-0.00204183,0.00046649
 ,0.24485419,0.00147646,-0.00525726,-0.00063572,-0.00206166,0.00331572,
 0.00077861,-0.00078795,0.00243205,-0.00049037,-0.00052402,-0.00235432,
 0.00038358,0.00435813,-0.00353896,0.00431353,0.09232296,-0.14339538,-0
 .05620230,0.06562272,-0.07760436,-0.02289026,0.00441285,0.00462591,-0.
 00391373,-0.01449302,0.00391585,0.01239578,-0.12183964,0.57044972,-0.0
 0093275,-0.00334554,-0.00382938,-0.00015759,0.00196934,0.00235374,0.00
 079565,0.00049063,0.00133877,-0.00065938,0.00605035,-0.00618138,0.0365
 6771,-0.01408601,-0.00686466,0.10352641,-0.01417121,-0.15794093,-0.010
 05905,-0.00937055,0.02777816,0.00005022,-0.00189913,0.00065362,0.00470
 724,0.00364967,-0.00136057,-0.16470110,-0.12062988,0.26546538,0.009705
 84,0.00632040,-0.01503098,-0.00143425,-0.00167325,0.00106913,-0.003800
 91,-0.00076940,0.00051453,-0.08607305,-0.03832351,0.08215498,-0.020483
 14,-0.01272812,0.02883608,-0.00441532,0.00405897,-0.00403427,0.0010332
 2,-0.00098595,0.00030897,0.00581540,0.00341787,-0.00525598,0.00329760,
 -0.00086321,-0.00171984,-0.00131702,0.00060415,0.00279306,0.09581983,0
 .00669167,0.00730685,-0.00941360,-0.00103940,-0.00141023,0.00067077,-0
 .00235999,0.00026469,-0.00005145,-0.03540925,-0.07518603,0.07096505,0.
 00215878,0.00273344,-0.00415408,0.00127813,-0.00106155,0.00046366,-0.0
 0084399,0.00077140,0.00018626,-0.01560562,-0.03126142,0.02863456,-0.00
 004445,0.00132515,0.00017774,0.00000384,0.00031489,-0.00040896,0.04086
 541,0.10129739,0.01124578,0.00916820,-0.02646702,-0.00280655,-0.002412
 29,0.00242193,-0.00358714,-0.00159855,0.00009856,0.08820752,0.08212849
 ,-0.23477673,0.00003819,-0.00013662,0.00108167,-0.00083138,0.00065758,
 0.00077733,0.00005883,-0.00031239,0.00000438,-0.00224696,0.00212627,0.
 00747870,-0.00009584,-0.00094069,0.00038493,-0.00018652,-0.00011054,0.
 00041654,-0.08982046,-0.08686757,0.24805104,-0.00441531,0.00405861,0.0
 0403392,0.00103306,-0.00098565,-0.00030909,-0.00131724,0.00060419,-0.0
 0279295,-0.02048494,-0.01272839,-0.02883586,-0.08607021,-0.03832591,-0
 .08215474,0.00970526,0.00632028,0.01503131,-0.00143423,-0.00167255,-0.
 00106928,0.00329783,-0.00086359,0.00172005,0.00581563,0.00341915,0.005
 25565,-0.00380096,-0.00076940,-0.00051430,0.00203248,-0.00050006,-0.00
 004922,0.09581934,0.00127796,-0.00106129,-0.00046355,-0.00084351,0.000
 77124,-0.00018630,0.00000388,0.00031479,0.00040897,0.00215860,0.002733
 46,0.00415335,-0.03541203,-0.07518624,-0.07097124,0.00669134,0.0073063
 4,0.00941262,-0.00103911,-0.00140988,-0.00067021,-0.00004409,0.0013250
 5,-0.00017772,-0.01560450,-0.03126640,-0.02863039,-0.00235996,0.000264
 78,0.00005160,-0.00050003,0.00020933,-0.00016735,0.04086697,0.10130205
 ,0.00083147,-0.00065766,0.00077730,-0.00005883,0.00031242,0.00000448,0
 .00018661,0.00011053,0.00041658,-0.00003871,0.00013663,0.00108180,-0.0
 8820641,-0.08213256,-0.23477807,-0.01124620,-0.00916919,-0.02646685,0.
 00280653,0.00241134,0.00242252,0.00009593,0.00094058,0.00038488,0.0022
 4741,-0.00212454,0.00747965,0.00358693,0.00159873,0.00009856,0.0000493
 0,0.00016741,0.00117165,0.08981997,0.08687157,0.24805074,-0.00131741,0
 .00211690,-0.00032376,0.00153803,-0.00115781,0.00010445,0.00080888,-0.
 00099040,0.00054771,-0.00047326,0.00042064,0.00011904,-0.00454090,0.00
 667162,0.00289947,0.00148171,0.03015038,-0.01983092,-0.00345925,0.0070
 5008,0.00774827,-0.00001932,-0.00154936,0.00043730,0.00373087,-0.00164
 423,-0.00721600,-0.03466905,-0.02222041,0.02844096,-0.00018932,-0.0000
 1260,0.00004901,0.00033430,-0.00033497,-0.00069893,0.03974027,-0.00027
 082,0.00189528,0.00047731,0.00071288,-0.00135505,-0.00003235,0.0001908
 7,-0.00069341,0.00000538,-0.00023131,-0.00177080,0.00067765,-0.0004269
 3,0.00627158,-0.00059063,0.01347697,-0.04471450,0.00537279,0.00109563,
 0.00614720,-0.00096499,0.00006629,-0.00083154,0.00029675,0.00291602,-0
 .00545118,-0.00264621,0.00298889,-0.35323477,0.15126241,-0.00087838,0.
 00021110,-0.00000958,-0.00005727,-0.00075439,-0.00005787,-0.01771482,0
 .39433094,0.00058519,-0.00058688,0.00099543,-0.00100185,0.00053859,-0.
 00140144,-0.00046675,0.00046189,-0.00056845,0.00032322,-0.00025999,0.0
 0028163,0.00405933,-0.00870618,-0.00408253,-0.01028349,-0.01395221,0.0
 1422366,0.00996594,-0.00619451,-0.00013310,-0.00008443,0.00144956,-0.0
 0100238,-0.00712045,0.00010809,-0.00042922,0.01598555,0.17913748,-0.11
 866274,0.00026675,-0.00007276,-0.00008050,0.00052475,0.00060931,-0.000
 46355,-0.01270472,-0.15373203,0.10649292,0.00148245,0.03015122,0.01983
 197,-0.00346045,0.00705072,-0.00774825,-0.03467021,-0.02222601,-0.0284
 4451,-0.00454170,0.00667257,-0.00289973,-0.00047318,0.00042063,-0.0001
 1905,-0.00131736,0.00211697,0.00032396,0.00153821,-0.00115790,-0.00010
 466,0.00373242,-0.00164419,0.00721578,-0.00001922,-0.00154947,-0.00043
 723,0.00080886,-0.00099043,-0.00054780,0.00033429,-0.00033505,0.000698
 95,-0.00018938,-0.00001260,-0.00004903,-0.00002888,0.00018950,-0.00002
 078,0.03974215,0.01347882,-0.04471602,-0.00537426,0.00109528,0.0061472
 6,0.00096508,0.00298334,-0.35322159,-0.15126743,-0.00042701,0.00627213
 ,0.00059071,-0.00023136,-0.00177091,-0.00067767,-0.00027084,0.00189548
 ,-0.00047726,0.00071308,-0.00135512,0.00003228,0.00291704,-0.00545105,
 0.00264627,0.00006642,-0.00083159,-0.00029663,0.00019090,-0.00069347,-
 0.00000545,-0.00005724,-0.00075437,0.00005797,-0.00087846,0.00021111,0
 .00000959,0.00018949,0.00006693,-0.00008474,-0.01771134,0.39431836,0.0
 1028372,0.01395098,0.01422328,-0.00996570,0.00619349,-0.00013238,-0.01
 598797,-0.17914121,-0.11867076,-0.00406038,0.00870586,-0.00408250,-0.0
 0032299,0.00025997,0.00028149,-0.00058516,0.00058718,0.00099549,0.0010
 0221,-0.00053869,-0.00140141,0.00712111,-0.00010796,-0.00043055,0.0000
 8458,-0.00144943,-0.00100208,0.00046674,-0.00046201,-0.00056852,-0.000
 52477,-0.00060924,-0.00046361,-0.00026682,0.00007278,-0.00008049,0.000
 02080,0.00008474,0.00014184,0.01270697,0.15373762,0.10650140,0.0009627
 3,-0.00353673,-0.00046716,-0.00107503,0.00349909,0.00151541,-0.0003102
 8,0.00285571,-0.00065696,0.00854353,0.00026665,-0.00616379,0.00250961,
 0.00351765,-0.00076448,-0.00685277,0.02327687,-0.00482294,0.00417319,-
 0.01509222,-0.00155272,-0.23877354,-0.12945093,0.17271871,-0.00350497,
 -0.00204749,0.00147106,0.00446361,-0.00796537,0.00003387,-0.00014047,0
 .00536303,-0.00096189,-0.00018516,-0.00021064,-0.00028754,0.00110978,0
 .00086512,-0.00107357,-0.00404762,-0.00292310,-0.00104544,0.23134435,-
 0.00017865,-0.00262719,0.00075280,0.00027664,0.00075345,-0.00024563,0.
 00005852,0.00118732,0.00062500,-0.02920900,-0.03125015,0.02464562,0.00
 121592,-0.00073585,0.00135624,0.00583558,-0.00236629,-0.00363874,-0.00
 539271,-0.00516698,0.00321532,-0.09340116,-0.11082190,0.07845629,-0.00
 119168,0.00141845,0.00015114,-0.00013355,-0.00042800,0.00106787,0.0010
 5812,-0.00479914,-0.00154196,0.00045402,0.00003855,0.00004087,0.000448
 97,-0.00000002,-0.00018462,-0.00142354,-0.00011718,-0.00146858,0.12173
 559,0.15513613,0.00027397,-0.00252654,0.00271415,0.00007913,-0.0015172
 7,-0.00206942,-0.00002574,-0.00097358,-0.00271396,-0.00323247,0.006195
 96,-0.00154742,-0.00009037,0.00010201,0.00041501,0.00227162,-0.0151182
 3,0.00629924,-0.00574707,0.00979689,-0.00728424,0.16732643,0.10080509,
 -0.14096351,0.00199607,-0.00037096,-0.00156025,-0.00209024,0.00575383,
 0.00001720,-0.00013326,0.00094345,0.00064669,-0.00052684,0.00063127,-0
 .00074554,-0.00058357,-0.00041365,0.00118015,-0.00099021,-0.00026961,0
 .00350897,-0.15823501,-0.10313522,0.14190923,-0.00685122,0.02326847,0.
 00482226,0.00416912,-0.01508883,0.00155287,0.00446260,-0.00796252,-0.0
 0003468,0.00250984,0.00351686,0.00076454,0.00854383,0.00027421,0.00616
 552,0.00096175,-0.00353525,0.00046738,-0.00107461,0.00349808,-0.001515
 01,-0.00350447,-0.00204706,-0.00147040,-0.23881988,-0.12950993,-0.1726
 9987,-0.00030995,0.00285466,0.00065684,-0.00018518,-0.00021046,0.00028
 768,-0.00014045,0.00536270,0.00096150,-0.00404643,-0.00292263,0.001045
 30,0.00110963,0.00086498,0.00107311,0.00178304,-0.00015307,-0.00029245
 ,0.23139239,0.00583370,-0.00236634,0.00363778,-0.00539284,-0.00516440,
 -0.00321573,-0.00013388,-0.00042729,-0.00106779,0.00121557,-0.00073470
 ,-0.00135557,-0.02920912,-0.03124609,-0.02463585,-0.00017812,-0.002627
 65,-0.00075335,0.00027663,0.00075318,0.00024606,-0.00119172,0.00141875
 ,-0.00015131,-0.09345290,-0.11086929,-0.07847062,0.00005842,0.00118760
 ,-0.00062514,0.00045419,0.00003850,-0.00004098,0.00105807,-0.00479852,
 0.00154214,-0.00142348,-0.00011739,0.00146898,0.00044892,0.00000002,0.
 00018452,-0.00015322,-0.00022120,0.00009656,0.12178979,0.15517484,-0.0
 0227178,0.01511481,0.00629835,0.00574530,-0.00979530,-0.00728115,0.002
 09018,-0.00575284,0.00001673,0.00009040,-0.00010244,0.00041599,0.00323
 526,-0.00619016,-0.00154836,-0.00027436,0.00252749,0.00271347,-0.00007
 888,0.00151713,-0.00206930,-0.00199548,0.00037080,-0.00156013,-0.16730
 889,-0.10081452,-0.14089760,0.00002571,0.00097327,-0.00271379,0.000526
 74,-0.00063124,-0.00074555,0.00013345,-0.00094472,0.00064635,0.0009908
 8,0.00027028,0.00350830,0.00058362,0.00041353,0.00117983,0.00029246,-0
 .00009639,0.00019372,0.15821541,0.10314030,0.14184316\\-0.00001193,-0.
 00000804,0.00000045,-0.00000084,0.00001072,-0.00000419,0.00000078,0.00
 000084,-0.00000117,0.00000368,0.00000365,0.00000479,0.00000685,0.00001
 662,-0.00000535,-0.00000431,-0.00000008,0.00000121,0.00000593,-0.00000
 806,0.00000075,-0.00000350,-0.00000062,-0.00000338,0.00000435,-0.00000
 089,-0.00000698,-0.00000050,-0.00000004,0.00000224,0.00000179,0.000003
 41,0.00000244,-0.00000476,-0.00000719,0.00000482,-0.00000070,-0.000002
 93,-0.00000028,0.00000284,0.00000232,0.00000109,0.00000158,-0.00000414
 ,-0.00000092,-0.00000125,-0.00000557,0.00000448\\\@


 WE DON'T KNOW ONE MILLIONTH OF ONE PERCENT ABOUT
 ANYTHING.
                                     T. A. EDISON.
 Job cpu time:       0 days  6 hours  0 minutes 42.7 seconds.
 Elapsed time:       0 days  0 hours 45 minutes 50.9 seconds.
 File lengths (MBytes):  RWF=    252 Int=      0 D2E=      0 Chk=     10 Scr=      2
 Normal termination of Gaussian 16 at Wed Jul 28 20:01:38 2021.
